NP-MRD: Showing NP-Card for Ganoderic acid Mc (NP0335283)

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Record Information

Version

2.0

Created at

2024-09-11 00:53:47 UTC

Updated at

2024-09-11 00:53:47 UTC

NP-MRD ID

NP0335283

Secondary Accession Numbers

None

Natural Product Identification

Common Name

Ganoderic acid Mc

Description

Ganoderic acid Mc is also known as ganoderate MC. Based on a literature review very few articles have been published on Ganoderic acid Mc.

Structure

MOL SDF PDB SMILES InChI


  Mrv2104 05262303262D          

 45 48  0  0  0  0            999 V2000
    0.0975    0.5021    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.1583   -2.6675    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.6520   -3.3188    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.1117    1.9701    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.1435    0.5136    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.4231    0.8525    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.4206    0.4922    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.3344   -1.6191    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.8185   -2.0212    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6563    0.2981    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0979   -0.9134    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.7193   -1.0263    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.5223   -1.7643    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.9587   -1.3287    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.1465   -1.4739    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.7102   -1.9095    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.1245   -0.4595    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.3632    0.5635    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4088   -0.1493    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.8474   -1.9033    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.8347   -3.2060    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.2996    1.8249    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.3314    0.3684    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.8026   -0.9884    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.3538   -1.2520    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.0302   -1.7905    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.5511    0.4183    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.8950   -0.0672    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.8073    0.0035    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.2390   -0.5527    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.2708   -0.3577    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2261   -0.0364    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.7071    0.0780    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.6147   -0.8432    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.1784   -1.2788    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.4587   -0.5029    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.3284   -3.8573    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.7677    2.4556    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.7996    0.9991    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.8341    0.8280    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5370    0.7278    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7324   -0.6877    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.5238   -2.4418    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.0193    1.0490    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.0511   -0.4075    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
 12 11  1  0  0  0  0
 15 14  1  0  0  0  0
 16 13  1  0  0  0  0
 19  1  1  0  0  0  0
 19 11  2  0  0  0  0
 20  2  1  0  0  0  0
 21  3  1  0  0  0  0
 22  4  1  0  0  0  0
 23  5  1  0  0  0  0
 24 13  1  0  0  0  0
 25 17  1  0  0  0  0
 25 20  1  0  0  0  0
 26 12  1  0  0  0  0
 26 20  1  0  0  0  0
 27 18  1  0  0  0  0
 28 18  1  0  0  0  0
 29 17  1  0  0  0  0
 30 14  1  0  0  0  0
 31 24  2  0  0  0  0
 31 27  1  0  0  0  0
 32 19  1  0  0  0  0
 33  6  1  0  0  0  0
 33  7  1  0  0  0  0
 33 28  1  0  0  0  0
 33 30  1  0  0  0  0
 34  8  1  0  0  0  0
 34 15  1  0  0  0  0
 34 24  1  0  0  0  0
 34 28  1  0  0  0  0
 35  9  1  0  0  0  0
 35 16  1  0  0  0  0
 35 25  1  0  0  0  0
 36 10  1  0  0  0  0
 36 29  1  0  0  0  0
 36 31  1  0  0  0  0
 36 35  1  0  0  0  0
 37 21  2  0  0  0  0
 38 22  2  0  0  0  0
 39 23  2  0  0  0  0
 40 29  1  0  0  0  0
 41 32  2  0  0  0  0
 42 32  1  0  0  0  0
 43 21  1  0  0  0  0
 43 26  1  0  0  0  0
 44 22  1  0  0  0  0
 44 27  1  0  0  0  0
 45 23  1  0  0  0  0
 45 30  1  0  0  0  0
M  END


  Mrv2104 05262303262D          

 45 48  0  0  0  0            999 V2000
    0.0975    0.5021    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.1583   -2.6675    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.6520   -3.3188    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.1117    1.9701    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.1435    0.5136    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.4231    0.8525    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.4206    0.4922    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.3344   -1.6191    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.8185   -2.0212    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6563    0.2981    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0979   -0.9134    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.7193   -1.0263    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.5223   -1.7643    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.9587   -1.3287    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.1465   -1.4739    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.7102   -1.9095    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.1245   -0.4595    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.3632    0.5635    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4088   -0.1493    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.8474   -1.9033    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.8347   -3.2060    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.2996    1.8249    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.3314    0.3684    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.8026   -0.9884    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.3538   -1.2520    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.0302   -1.7905    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.5511    0.4183    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.8950   -0.0672    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.8073    0.0035    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.2390   -0.5527    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.2708   -0.3577    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2261   -0.0364    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.7071    0.0780    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.6147   -0.8432    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.1784   -1.2788    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.4587   -0.5029    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.3284   -3.8573    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.7677    2.4556    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.7996    0.9991    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.8341    0.8280    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5370    0.7278    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7324   -0.6877    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.5238   -2.4418    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.0193    1.0490    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.0511   -0.4075    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
 12 11  1  0  0  0  0
 15 14  1  0  0  0  0
 16 13  1  0  0  0  0
 19  1  1  0  0  0  0
 19 11  2  0  0  0  0
 20  2  1  0  0  0  0
 21  3  1  0  0  0  0
 22  4  1  0  0  0  0
 23  5  1  0  0  0  0
 24 13  1  0  0  0  0
 25 17  1  0  0  0  0
 25 20  1  0  0  0  0
 26 12  1  0  0  0  0
 26 20  1  0  0  0  0
 27 18  1  0  0  0  0
 28 18  1  0  0  0  0
 29 17  1  0  0  0  0
 30 14  1  0  0  0  0
 31 24  2  0  0  0  0
 31 27  1  0  0  0  0
 32 19  1  0  0  0  0
 33  6  1  0  0  0  0
 33  7  1  0  0  0  0
 33 28  1  0  0  0  0
 33 30  1  0  0  0  0
 34  8  1  0  0  0  0
 34 15  1  0  0  0  0
 34 24  1  0  0  0  0
 34 28  1  0  0  0  0
 35  9  1  0  0  0  0
 35 16  1  0  0  0  0
 35 25  1  0  0  0  0
 36 10  1  0  0  0  0
 36 29  1  0  0  0  0
 36 31  1  0  0  0  0
 36 35  1  0  0  0  0
 37 21  2  0  0  0  0
 38 22  2  0  0  0  0
 39 23  2  0  0  0  0
 40 29  1  0  0  0  0
 41 32  2  0  0  0  0
 42 32  1  0  0  0  0
 43 21  1  0  0  0  0
 43 26  1  0  0  0  0
 44 22  1  0  0  0  0
 44 27  1  0  0  0  0
 45 23  1  0  0  0  0
 45 30  1  0  0  0  0
M  END
> <DATABASE_ID>
NP0335283

> <DATABASE_NAME>
NP-MRD

> <SMILES>
CC(C(C\C=C(/C)C(O)=O)OC(C)=O)C1CC(O)C2(C)C3=C(CCC12C)C1(C)CCC(OC(C)=O)C(C)(C)C1CC3OC(C)=O

> <INCHI_IDENTIFIER>
InChI=1/C36H54O9/c1-19(32(41)42)11-12-26(43-21(3)37)20(2)25-17-29(40)36(10)31-24(13-16-35(25,36)9)34(8)15-14-30(45-23(5)39)33(6,7)28(34)18-27(31)44-22(4)38/h11,20,25-30,40H,12-18H2,1-10H3,(H,41,42)/b19-11+

> <INCHI_KEY>
GHQBLEWBYHWXAC-YBFXNURJNA-N

> <FORMULA>
C36H54O9

> <MOLECULAR_WEIGHT>
630.819

> <EXACT_MASS>
630.376783319

> <JCHEM_ACCEPTOR_COUNT>
6

> <JCHEM_ATOM_COUNT>
99

> <JCHEM_AVERAGE_POLARIZABILITY>
71.24401282016841

> <JCHEM_BIOAVAILABILITY>
0

> <JCHEM_DONOR_COUNT>
2

> <JCHEM_FORMAL_CHARGE>
0

> <JCHEM_GHOSE_FILTER>
0

> <JCHEM_IUPAC>
(2E)-5-(acetyloxy)-6-[4,7-bis(acetyloxy)-3-hydroxy-3a,6,6,9a,11a-pentamethyl-1H,2H,3H,3aH,4H,5H,5aH,6H,7H,8H,9H,9aH,10H,11H,11aH-cyclopenta[a]phenanthren-1-yl]-2-methylhept-2-enoic acid

> <JCHEM_LOGP>
4.4513544199999995

> <JCHEM_MDDR_LIKE_RULE>
1

> <JCHEM_NUMBER_OF_RINGS>
4

> <JCHEM_PHYSIOLOGICAL_CHARGE>
-1

> <JCHEM_PKA>
14.616964667117461

> <JCHEM_PKA_STRONGEST_ACIDIC>
4.2239508430786215

> <JCHEM_PKA_STRONGEST_BASIC>
-2.9663396546167586

> <JCHEM_POLAR_SURFACE_AREA>
136.43

> <JCHEM_REFRACTIVITY>
168.3399

> <JCHEM_ROTATABLE_BOND_COUNT>
11

> <JCHEM_RULE_OF_FIVE>
0

> <JCHEM_TRADITIONAL_IUPAC>
(2E)-5-(acetyloxy)-6-[4,7-bis(acetyloxy)-3-hydroxy-3a,6,6,9a,11a-pentamethyl-1H,2H,3H,4H,5H,5aH,7H,8H,9H,10H,11H-cyclopenta[a]phenanthren-1-yl]-2-methylhept-2-enoic acid

> <JCHEM_VEBER_RULE>
0

$$$$

HEADER    PROTEIN                                 26-MAY-23   NONE
TITLE     NULL                                                        
COMPND    NULL                                                        
SOURCE    NULL                                                        
KEYWDS    NULL                                                        
EXPDTA    NULL                                                        
AUTHOR    Marvin                                                      
REVDAT   1   26-MAY-23         0                                  
HETATM    1  C   UNK     0       0.182   0.937   0.000  0.00  0.00           C+0
HETATM    2  C   UNK     0       4.029  -4.979   0.000  0.00  0.00           C+0
HETATM    3  C   UNK     0       3.084  -6.195   0.000  0.00  0.00           C+0
HETATM    4  C   UNK     0       9.542   3.678   0.000  0.00  0.00           C+0
HETATM    5  C   UNK     0      17.068   0.959   0.000  0.00  0.00           C+0
HETATM    6  C   UNK     0      11.990   1.591   0.000  0.00  0.00           C+0
HETATM    7  C   UNK     0      13.852   0.919   0.000  0.00  0.00           C+0
HETATM    8  C   UNK     0       9.958  -3.022   0.000  0.00  0.00           C+0
HETATM    9  C   UNK     0       5.261  -3.773   0.000  0.00  0.00           C+0
HETATM   10  C   UNK     0       6.825   0.556   0.000  0.00  0.00           C+0
HETATM   11  C   UNK     0      -0.183  -1.705   0.000  0.00  0.00           C+0
HETATM   12  C   UNK     0       1.343  -1.916   0.000  0.00  0.00           C+0
HETATM   13  C   UNK     0       8.442  -3.293   0.000  0.00  0.00           C+0
HETATM   14  C   UNK     0      12.990  -2.480   0.000  0.00  0.00           C+0
HETATM   15  C   UNK     0      11.473  -2.751   0.000  0.00  0.00           C+0
HETATM   16  C   UNK     0       6.926  -3.564   0.000  0.00  0.00           C+0
HETATM   17  C   UNK     0       3.966  -0.858   0.000  0.00  0.00           C+0
HETATM   18  C   UNK     0      10.011   1.052   0.000  0.00  0.00           C+0
HETATM   19  C   UNK     0      -0.763  -0.279   0.000  0.00  0.00           C+0
HETATM   20  C   UNK     0       3.448  -3.553   0.000  0.00  0.00           C+0
HETATM   21  C   UNK     0       1.558  -5.985   0.000  0.00  0.00           C+0
HETATM   22  C   UNK     0       8.026   3.406   0.000  0.00  0.00           C+0
HETATM   23  C   UNK     0      15.552   0.688   0.000  0.00  0.00           C+0
HETATM   24  C   UNK     0       8.965  -1.845   0.000  0.00  0.00           C+0
HETATM   25  C   UNK     0       4.394  -2.337   0.000  0.00  0.00           C+0
HETATM   26  C   UNK     0       1.923  -3.342   0.000  0.00  0.00           C+0
HETATM   27  C   UNK     0       8.495   0.781   0.000  0.00  0.00           C+0
HETATM   28  C   UNK     0      11.004  -0.125   0.000  0.00  0.00           C+0
HETATM   29  C   UNK     0       5.240   0.007   0.000  0.00  0.00           C+0
HETATM   30  C   UNK     0      13.513  -1.032   0.000  0.00  0.00           C+0
HETATM   31  C   UNK     0       7.972  -0.668   0.000  0.00  0.00           C+0
HETATM   32  C   UNK     0      -2.289  -0.068   0.000  0.00  0.00           C+0
HETATM   33  C   UNK     0      12.520   0.146   0.000  0.00  0.00           C+0
HETATM   34  C   UNK     0      10.481  -1.574   0.000  0.00  0.00           C+0
HETATM   35  C   UNK     0       5.933  -2.387   0.000  0.00  0.00           C+0
HETATM   36  C   UNK     0       6.456  -0.939   0.000  0.00  0.00           C+0
HETATM   37  O   UNK     0       0.613  -7.200   0.000  0.00  0.00           O+0
HETATM   38  O   UNK     0       7.033   4.584   0.000  0.00  0.00           O+0
HETATM   39  O   UNK     0      14.559   1.865   0.000  0.00  0.00           O+0
HETATM   40  O   UNK     0       5.290   1.546   0.000  0.00  0.00           O+0
HETATM   41  O   UNK     0      -2.869   1.359   0.000  0.00  0.00           O+0
HETATM   42  O   UNK     0      -3.234  -1.284   0.000  0.00  0.00           O+0
HETATM   43  O   UNK     0       0.978  -4.558   0.000  0.00  0.00           O+0
HETATM   44  O   UNK     0       7.503   1.958   0.000  0.00  0.00           O+0
HETATM   45  O   UNK     0      15.029  -0.761   0.000  0.00  0.00           O+0
CONECT    1   19                                                            
CONECT    2   20                                                            
CONECT    3   21                                                            
CONECT    4   22                                                            
CONECT    5   23                                                            
CONECT    6   33                                                            
CONECT    7   33                                                            
CONECT    8   34                                                            
CONECT    9   35                                                            
CONECT   10   36                                                            
CONECT   11   12   19                                                       
CONECT   12   11   26                                                       
CONECT   13   16   24                                                       
CONECT   14   15   30                                                       
CONECT   15   14   34                                                       
CONECT   16   13   35                                                       
CONECT   17   25   29                                                       
CONECT   18   27   28                                                       
CONECT   19    1   11   32                                                  
CONECT   20    2   25   26                                                  
CONECT   21    3   37   43                                                  
CONECT   22    4   38   44                                                  
CONECT   23    5   39   45                                                  
CONECT   24   13   31   34                                                  
CONECT   25   17   20   35                                                  
CONECT   26   12   20   43                                                  
CONECT   27   18   31   44                                                  
CONECT   28   18   33   34                                                  
CONECT   29   17   36   40                                                  
CONECT   30   14   33   45                                                  
CONECT   31   24   27   36                                                  
CONECT   32   19   41   42                                                  
CONECT   33    6    7   28   30                                             
CONECT   34    8   15   24   28                                             
CONECT   35    9   16   25   36                                             
CONECT   36   10   29   31   35                                             
CONECT   37   21                                                            
CONECT   38   22                                                            
CONECT   39   23                                                            
CONECT   40   29                                                            
CONECT   41   32                                                            
CONECT   42   32                                                            
CONECT   43   21   26                                                       
CONECT   44   22   27                                                       
CONECT   45   23   30                                                       
MASTER        0    0    0    0    0    0    0    0   45    0   96    0
END

View in JSmol

Synonyms

Value	Source
Ganoderate MC	Generator

Chemical Formula

C₃₆H₅₄O₉

Average Mass

630.8190 Da

Monoisotopic Mass

630.37678 Da

IUPAC Name

(2E)-5-(acetyloxy)-6-[4,7-bis(acetyloxy)-3-hydroxy-3a,6,6,9a,11a-pentamethyl-1H,2H,3H,3aH,4H,5H,5aH,6H,7H,8H,9H,9aH,10H,11H,11aH-cyclopenta[a]phenanthren-1-yl]-2-methylhept-2-enoic acid

Traditional Name

(2E)-5-(acetyloxy)-6-[4,7-bis(acetyloxy)-3-hydroxy-3a,6,6,9a,11a-pentamethyl-1H,2H,3H,4H,5H,5aH,7H,8H,9H,10H,11H-cyclopenta[a]phenanthren-1-yl]-2-methylhept-2-enoic acid

CAS Registry Number

Not Available

SMILES

CC(C(C\C=C(/C)C(O)=O)OC(C)=O)C1CC(O)C2(C)C3=C(CCC12C)C1(C)CCC(OC(C)=O)C(C)(C)C1CC3OC(C)=O

InChI Identifier

InChI=1/C36H54O9/c1-19(32(41)42)11-12-26(43-21(3)37)20(2)25-17-29(40)36(10)31-24(13-16-35(25,36)9)34(8)15-14-30(45-23(5)39)33(6,7)28(34)18-27(31)44-22(4)38/h11,20,25-30,40H,12-18H2,1-10H3,(H,41,42)/b19-11+

InChI Key

GHQBLEWBYHWXAC-YBFXNURJNA-N

Experimental Spectra

Not Available

Predicted Spectra

Not Available

Chemical Shift Submissions

Not Available

Species

Species of Origin

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
logP	4.45	ChemAxon
pKa (Strongest Acidic)	4.22	ChemAxon
pKa (Strongest Basic)	-3	ChemAxon
Physiological Charge	-1	ChemAxon
Hydrogen Acceptor Count	6	ChemAxon
Hydrogen Donor Count	2	ChemAxon
Polar Surface Area	136.43 Å²	ChemAxon
Rotatable Bond Count	11	ChemAxon
Refractivity	168.34 m³·mol⁻¹	ChemAxon
Polarizability	71.24 Å³	ChemAxon
Number of Rings	4	ChemAxon
Bioavailability	No	ChemAxon
Rule of Five	No	ChemAxon
Ghose Filter	No	ChemAxon
Veber's Rule	No	ChemAxon
MDDR-like Rule	Yes	ChemAxon

External Links

HMDB ID

Not Available

DrugBank ID

Not Available

Phenol Explorer Compound ID

Not Available

FoodDB ID

Not Available

KNApSAcK ID

Not Available

Chemspider ID

Not Available

KEGG Compound ID

Not Available

BioCyc ID

Not Available

BiGG ID

Not Available

Wikipedia Link

Not Available

METLIN ID

Not Available

PubChem Compound

Not Available

PDB ID

Not Available

ChEBI ID

Not Available

Good Scents ID

Not Available

References

General References

Showing NP-Card for Ganoderic acid Mc (NP0335283)

MOL for NP0335283 (Ganoderic acid Mc)

3D MOL for NP0335283 (Ganoderic acid Mc)

3D SDF for NP0335283 (Ganoderic acid Mc)

3D-SDF for NP0335283 (Ganoderic acid Mc)

PDB for NP0335283 (Ganoderic acid Mc)

3D PDB for NP0335283 (Ganoderic acid Mc)

SMILES for NP0335283 (Ganoderic acid Mc)

INCHI for NP0335283 (Ganoderic acid Mc)

Structure for NP0335283 (Ganoderic acid Mc)

3D Structure for NP0335283 (Ganoderic acid Mc)