NP-MRD: Showing NP-Card for 3a,3b-dimethoxyhopeachinol B (NP0353496)

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Record Information

Version

2.0

Created at

2026-02-22 10:02:44 UTC

Updated at

2026-02-22 12:01:27 UTC

NP-MRD ID

NP0353496

Natural Product DOI

https://doi.org/10.57994/8004

Secondary Accession Numbers

None

Natural Product Identification

Common Name

3a,3b-dimethoxyhopeachinol B

Description

3a,3b-dimethoxyhopeachinol B was first documented in 2024 (PMID: 36924397).

Structure

MOL SDF PDB SMILES InChI


  Mrv2104 03232307152D          

 52 59  0  0  1  0            999 V2000
    5.7103    2.8450    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.1885    2.2060    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.6104    1.4971    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.4779    0.6828    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.1169    0.1609    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.9944   -0.5481    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.8883    0.4534    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.0208    1.2677    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.7922    1.5601    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.3818    1.7895    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.8530    0.1442    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
    5.1722   -0.6166    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
    4.3495   -0.5556    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.7443   -1.3220    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.9195   -1.3041    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.4917   -2.0095    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.8886   -2.7327    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.4608   -3.4381    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.7134   -2.7506    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.1104   -3.4738    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.6825   -4.1792    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.1413   -2.0452    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.5606    0.9156    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.0281    0.1332    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.3891    0.6551    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.2351    1.4656    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
    2.4167    1.5695    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
    2.0197    2.2928    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4476    2.9981    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.0507    3.7214    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2259    3.7392    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.8289    4.4624    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.7980    3.0338    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0268    3.0517    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4238    3.7749    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.1949    2.3106    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.5921    1.5442    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.0649    0.8233    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.6177    0.3626    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4852   -0.4517    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.1242   -0.9735    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.9917   -1.7878    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.8956   -0.6811    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.0494    1.3331    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.6381    2.1854    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.4095    2.4779    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.5420    3.2922    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.3134    3.5846    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.9030    3.8140    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.1316    3.5216    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4926    4.0435    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.9991    2.7073    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  2  0  0  0  0
  2  3  1  0  0  0  0
  3  4  2  0  0  0  0
  4  5  1  0  0  0  0
  5  6  1  0  0  0  0
  5  7  2  0  0  0  0
  7  8  1  0  0  0  0
  8  9  1  0  0  0  0
  8 10  2  0  0  0  0
  3 10  1  0  0  0  0
 11  4  1  0  0  0  0
 11 12  1  0  0  0  0
 12  6  1  0  0  0  0
 12 13  1  1  0  0  0
 12 14  1  6  0  0  0
 14 15  2  0  0  0  0
 15 16  1  0  0  0  0
 16 17  2  0  0  0  0
 17 18  1  0  0  0  0
 17 19  1  0  0  0  0
 19 20  1  0  0  0  0
 20 21  1  0  0  0  0
 19 22  2  0  0  0  0
 14 22  1  0  0  0  0
 11 23  1  6  0  0  0
 11 24  1  0  0  0  0
 24 25  2  0  0  0  0
 26 25  1  0  0  0  0
 26 27  1  0  0  0  0
 27 28  1  1  0  0  0
 28 29  2  0  0  0  0
 29 30  1  0  0  0  0
 30 31  2  0  0  0  0
 31 32  1  0  0  0  0
 31 33  1  0  0  0  0
 33 34  1  0  0  0  0
 34 35  1  0  0  0  0
 33 36  2  0  0  0  0
 28 36  1  0  0  0  0
 27 37  1  6  0  0  0
 27 38  1  0  0  0  0
 38 39  1  0  0  0  0
 25 39  1  0  0  0  0
 39 40  2  0  0  0  0
 40 41  1  0  0  0  0
 41 42  1  0  0  0  0
 41 43  2  0  0  0  0
 24 43  1  0  0  0  0
 26 44  1  1  0  0  0
 26 45  1  0  0  0  0
 45 46  2  0  0  0  0
  2 46  1  0  0  0  0
 46 47  1  0  0  0  0
 47 48  1  0  0  0  0
 47 49  2  0  0  0  0
 49 50  1  0  0  0  0
 50 51  1  0  0  0  0
 50 52  2  0  0  0  0
 45 52  1  0  0  0  0
M  END


  Mrv2104 03232307152D          

 52 59  0  0  1  0            999 V2000
    5.7103    2.8450    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.1885    2.2060    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.6104    1.4971    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.4779    0.6828    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.1169    0.1609    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.9944   -0.5481    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.8883    0.4534    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.0208    1.2677    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.7922    1.5601    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.3818    1.7895    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.8530    0.1442    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
    5.1722   -0.6166    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
    4.3495   -0.5556    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.7443   -1.3220    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.9195   -1.3041    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.4917   -2.0095    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.8886   -2.7327    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.4608   -3.4381    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.7134   -2.7506    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.1104   -3.4738    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.6825   -4.1792    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.1413   -2.0452    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.5606    0.9156    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.0281    0.1332    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.3891    0.6551    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.2351    1.4656    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
    2.4167    1.5695    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
    2.0197    2.2928    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4476    2.9981    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.0507    3.7214    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2259    3.7392    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.8289    4.4624    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.7980    3.0338    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0268    3.0517    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4238    3.7749    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.1949    2.3106    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.5921    1.5442    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.0649    0.8233    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.6177    0.3626    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4852   -0.4517    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.1242   -0.9735    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.9917   -1.7878    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.8956   -0.6811    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.0494    1.3331    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.6381    2.1854    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.4095    2.4779    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.5420    3.2922    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.3134    3.5846    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.9030    3.8140    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.1316    3.5216    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4926    4.0435    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.9991    2.7073    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  2  0  0  0  0
  2  3  1  0  0  0  0
  3  4  2  0  0  0  0
  4  5  1  0  0  0  0
  5  6  1  0  0  0  0
  5  7  2  0  0  0  0
  7  8  1  0  0  0  0
  8  9  1  0  0  0  0
  8 10  2  0  0  0  0
  3 10  1  0  0  0  0
 11  4  1  0  0  0  0
 11 12  1  0  0  0  0
 12  6  1  0  0  0  0
 12 13  1  1  0  0  0
 12 14  1  6  0  0  0
 14 15  2  0  0  0  0
 15 16  1  0  0  0  0
 16 17  2  0  0  0  0
 17 18  1  0  0  0  0
 17 19  1  0  0  0  0
 19 20  1  0  0  0  0
 20 21  1  0  0  0  0
 19 22  2  0  0  0  0
 14 22  1  0  0  0  0
 11 23  1  6  0  0  0
 11 24  1  0  0  0  0
 24 25  2  0  0  0  0
 26 25  1  0  0  0  0
 26 27  1  0  0  0  0
 27 28  1  1  0  0  0
 28 29  2  0  0  0  0
 29 30  1  0  0  0  0
 30 31  2  0  0  0  0
 31 32  1  0  0  0  0
 31 33  1  0  0  0  0
 33 34  1  0  0  0  0
 34 35  1  0  0  0  0
 33 36  2  0  0  0  0
 28 36  1  0  0  0  0
 27 37  1  6  0  0  0
 27 38  1  0  0  0  0
 38 39  1  0  0  0  0
 25 39  1  0  0  0  0
 39 40  2  0  0  0  0
 40 41  1  0  0  0  0
 41 42  1  0  0  0  0
 41 43  2  0  0  0  0
 24 43  1  0  0  0  0
 26 44  1  1  0  0  0
 26 45  1  0  0  0  0
 45 46  2  0  0  0  0
  2 46  1  0  0  0  0
 46 47  1  0  0  0  0
 47 48  1  0  0  0  0
 47 49  2  0  0  0  0
 49 50  1  0  0  0  0
 50 51  1  0  0  0  0
 50 52  2  0  0  0  0
 45 52  1  0  0  0  0
M  END
> <DATABASE_ID>
NP0353496

> <DATABASE_NAME>
NP-MRD

> <SMILES>
[H][C@@]1(OC2=CC(O)=CC3=C2[C@]1([H])C1=C2C(O[C@@]([H])(C4=CC=C(O)C(OC)=C4)[C@]2([H])C2=C(C(O)=CC(O)=C2)C3=O)=CC(O)=C1)C1=CC=C(O)C(OC)=C1

> <INCHI_IDENTIFIER>
InChI=1S/C37H28O11/c1-45-26-7-15(3-5-23(26)41)36-33-20-9-17(38)12-25(43)30(20)35(44)22-11-19(40)14-29-32(22)34(21-10-18(39)13-28(47-36)31(21)33)37(48-29)16-4-6-24(42)27(8-16)46-2/h3-14,33-34,36-43H,1-2H3/t33-,34+,36+,37-/m1/s1

> <INCHI_KEY>
TXDLKGAQKFUZCV-MAUQAKLKSA-N

> <FORMULA>
C37H28O11

> <MOLECULAR_WEIGHT>
648.62

> <EXACT_MASS>
648.163161722

$$$$

HEADER    PROTEIN                                 23-MAR-23   NONE
TITLE     NULL                                                        
COMPND    NULL                                                        
SOURCE    NULL                                                        
KEYWDS    NULL                                                        
EXPDTA    NULL                                                        
AUTHOR    Marvin                                                      
REVDAT   1   23-MAR-23         0                                  
HETATM    1  O   UNK     0      10.659   5.311   0.000  0.00  0.00           O+0
HETATM    2  C   UNK     0       9.685   4.118   0.000  0.00  0.00           C+0
HETATM    3  C   UNK     0      10.473   2.795   0.000  0.00  0.00           C+0
HETATM    4  C   UNK     0      10.225   1.275   0.000  0.00  0.00           C+0
HETATM    5  C   UNK     0      11.418   0.300   0.000  0.00  0.00           C+0
HETATM    6  O   UNK     0      11.189  -1.023   0.000  0.00  0.00           O+0
HETATM    7  C   UNK     0      12.858   0.846   0.000  0.00  0.00           C+0
HETATM    8  C   UNK     0      13.105   2.366   0.000  0.00  0.00           C+0
HETATM    9  O   UNK     0      14.545   2.912   0.000  0.00  0.00           O+0
HETATM   10  C   UNK     0      11.913   3.340   0.000  0.00  0.00           C+0
HETATM   11  C   UNK     0       9.059   0.269   0.000  0.00  0.00           C+0
HETATM   12  C   UNK     0       9.655  -1.151   0.000  0.00  0.00           C+0
HETATM   13  H   UNK     0       8.119  -1.037   0.000  0.00  0.00           H+0
HETATM   14  C   UNK     0       8.856  -2.468   0.000  0.00  0.00           C+0
HETATM   15  C   UNK     0       7.316  -2.434   0.000  0.00  0.00           C+0
HETATM   16  C   UNK     0       6.518  -3.751   0.000  0.00  0.00           C+0
HETATM   17  C   UNK     0       7.259  -5.101   0.000  0.00  0.00           C+0
HETATM   18  O   UNK     0       6.460  -6.418   0.000  0.00  0.00           O+0
HETATM   19  C   UNK     0       8.798  -5.134   0.000  0.00  0.00           C+0
HETATM   20  O   UNK     0       9.539  -6.484   0.000  0.00  0.00           O+0
HETATM   21  C   UNK     0       8.741  -7.801   0.000  0.00  0.00           C+0
HETATM   22  C   UNK     0       9.597  -3.818   0.000  0.00  0.00           C+0
HETATM   23  H   UNK     0       8.513   1.709   0.000  0.00  0.00           H+0
HETATM   24  C   UNK     0       7.519   0.249   0.000  0.00  0.00           C+0
HETATM   25  C   UNK     0       6.326   1.223   0.000  0.00  0.00           C+0
HETATM   26  C   UNK     0       6.039   2.736   0.000  0.00  0.00           C+0
HETATM   27  C   UNK     0       4.511   2.930   0.000  0.00  0.00           C+0
HETATM   28  C   UNK     0       3.770   4.280   0.000  0.00  0.00           C+0
HETATM   29  C   UNK     0       4.569   5.597   0.000  0.00  0.00           C+0
HETATM   30  C   UNK     0       3.828   6.947   0.000  0.00  0.00           C+0
HETATM   31  C   UNK     0       2.288   6.980   0.000  0.00  0.00           C+0
HETATM   32  O   UNK     0       1.547   8.330   0.000  0.00  0.00           O+0
HETATM   33  C   UNK     0       1.490   5.663   0.000  0.00  0.00           C+0
HETATM   34  O   UNK     0      -0.050   5.696   0.000  0.00  0.00           O+0
HETATM   35  C   UNK     0      -0.791   7.047   0.000  0.00  0.00           C+0
HETATM   36  C   UNK     0       2.231   4.313   0.000  0.00  0.00           C+0
HETATM   37  H   UNK     0       2.972   2.882   0.000  0.00  0.00           H+0
HETATM   38  O   UNK     0       3.854   1.537   0.000  0.00  0.00           O+0
HETATM   39  C   UNK     0       4.886   0.677   0.000  0.00  0.00           C+0
HETATM   40  C   UNK     0       4.639  -0.843   0.000  0.00  0.00           C+0
HETATM   41  C   UNK     0       5.832  -1.817   0.000  0.00  0.00           C+0
HETATM   42  O   UNK     0       5.585  -3.337   0.000  0.00  0.00           O+0
HETATM   43  C   UNK     0       7.272  -1.271   0.000  0.00  0.00           C+0
HETATM   44  H   UNK     0       7.559   2.488   0.000  0.00  0.00           H+0
HETATM   45  C   UNK     0       6.791   4.080   0.000  0.00  0.00           C+0
HETATM   46  C   UNK     0       8.231   4.625   0.000  0.00  0.00           C+0
HETATM   47  C   UNK     0       8.478   6.145   0.000  0.00  0.00           C+0
HETATM   48  O   UNK     0       9.918   6.691   0.000  0.00  0.00           O+0
HETATM   49  C   UNK     0       7.286   7.120   0.000  0.00  0.00           C+0
HETATM   50  C   UNK     0       5.846   6.574   0.000  0.00  0.00           C+0
HETATM   51  O   UNK     0       4.653   7.548   0.000  0.00  0.00           O+0
HETATM   52  C   UNK     0       5.598   5.054   0.000  0.00  0.00           C+0
CONECT    1    2                                                            
CONECT    2    1    3   46                                                  
CONECT    3    2    4   10                                                  
CONECT    4    3    5   11                                                  
CONECT    5    4    6    7                                                  
CONECT    6    5   12                                                       
CONECT    7    5    8                                                       
CONECT    8    7    9   10                                                  
CONECT    9    8                                                            
CONECT   10    8    3                                                       
CONECT   11    4   12   23   24                                             
CONECT   12   11    6   13   14                                             
CONECT   13   12                                                            
CONECT   14   12   15   22                                                  
CONECT   15   14   16                                                       
CONECT   16   15   17                                                       
CONECT   17   16   18   19                                                  
CONECT   18   17                                                            
CONECT   19   17   20   22                                                  
CONECT   20   19   21                                                       
CONECT   21   20                                                            
CONECT   22   19   14                                                       
CONECT   23   11                                                            
CONECT   24   11   25   43                                                  
CONECT   25   24   26   39                                                  
CONECT   26   25   27   44   45                                             
CONECT   27   26   28   37   38                                             
CONECT   28   27   29   36                                                  
CONECT   29   28   30                                                       
CONECT   30   29   31                                                       
CONECT   31   30   32   33                                                  
CONECT   32   31                                                            
CONECT   33   31   34   36                                                  
CONECT   34   33   35                                                       
CONECT   35   34                                                            
CONECT   36   33   28                                                       
CONECT   37   27                                                            
CONECT   38   27   39                                                       
CONECT   39   38   25   40                                                  
CONECT   40   39   41                                                       
CONECT   41   40   42   43                                                  
CONECT   42   41                                                            
CONECT   43   41   24                                                       
CONECT   44   26                                                            
CONECT   45   26   46   52                                                  
CONECT   46   45    2   47                                                  
CONECT   47   46   48   49                                                  
CONECT   48   47                                                            
CONECT   49   47   50                                                       
CONECT   50   49   51   52                                                  
CONECT   51   50                                                            
CONECT   52   50   45                                                       
MASTER        0    0    0    0    0    0    0    0   52    0  118    0
END

View in JSmol

Synonyms

Not Available

Chemical Formula

C₃₇H₂₈O₁₁

Average Mass

648.6200 Da

Monoisotopic Mass

648.16316 Da

IUPAC Name

Not Available

Traditional Name

Not Available

CAS Registry Number

Not Available

SMILES

[H][C@@]1(OC2=CC(O)=CC3=C2[C@]1([H])C1=C2C(O[C@@]([H])(C4=CC=C(O)C(OC)=C4)[C@]2([H])C2=C(C(O)=CC(O)=C2)C3=O)=CC(O)=C1)C1=CC=C(O)C(OC)=C1

InChI Identifier

InChI=1S/C37H28O11/c1-45-26-7-15(3-5-23(26)41)36-33-20-9-17(38)12-25(43)30(20)35(44)22-11-19(40)14-29-32(22)34(21-10-18(39)13-28(47-36)31(21)33)37(48-29)16-4-6-24(42)27(8-16)46-2/h3-14,33-34,36-43H,1-2H3/t33-,34+,36+,37-/m1/s1

InChI Key

TXDLKGAQKFUZCV-MAUQAKLKSA-N

Experimental Spectra

Spectrum Type	Description	Depositor Email	Depositor Organization	Depositor	Deposition Date	View

Predicted Spectra

Not Available

Chemical Shift Submissions

Spectrum Type	Description	Depositor Email	Depositor Organization	Depositor	Deposition Date	View
1D NMR	¹H NMR Spectrum (1D, 600.0, Methanol-d4, simulated)	[email protected]	Not Available	Not Available	2026-02-22	View Spectrum
1D NMR	¹³C NMR Spectrum (1D, 150.0, Methanol-d4, simulated)	[email protected]	Not Available	Not Available	2026-02-22	View Spectrum

Species

Species of Origin

Species Name	Source	Reference
Trillium camschatcense		Not Available

Chemical Taxonomy

Classification

Not classified

Physical Properties

State

Not Available

Experimental Properties

Property	Value	Reference
Melting Point	Not Available	Not Available
Boiling Point	Not Available	Not Available
Water Solubility	Not Available	Not Available
LogP	Not Available	Not Available

Predicted Properties

Property	Value	Source

External Links

Not Available

References

General References

DOI: 10.1080/14786419.2023.2188211

Showing NP-Card for 3a,3b-dimethoxyhopeachinol B (NP0353496)

MOL for NP0353496 (3a,3b-dimethoxyhopeachinol B)

3D MOL for NP0353496 (3a,3b-dimethoxyhopeachinol B)

3D SDF for NP0353496 (3a,3b-dimethoxyhopeachinol B)

3D-SDF for NP0353496 (3a,3b-dimethoxyhopeachinol B)

PDB for NP0353496 (3a,3b-dimethoxyhopeachinol B)

3D PDB for NP0353496 (3a,3b-dimethoxyhopeachinol B)

SMILES for NP0353496 (3a,3b-dimethoxyhopeachinol B)

INCHI for NP0353496 (3a,3b-dimethoxyhopeachinol B)

Structure for NP0353496 (3a,3b-dimethoxyhopeachinol B)

3D Structure for NP0353496 (3a,3b-dimethoxyhopeachinol B)