NP-MRD: Showing NP-Card for Norzoazepanol (NP0351245)

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Record Information

Version

2.0

Created at

2025-06-28 18:15:16 UTC

Updated at

2025-06-28 20:01:39 UTC

NP-MRD ID

NP0351245

Natural Product DOI

https://doi.org/10.57994/4235

Secondary Accession Numbers

None

Natural Product Identification

Common Name

Norzoazepanol

Description

Norzoazepanol was first documented in 2025 (PMID: 40490901). Based on a literature review very few articles have been published on Norzoazepanol.

Structure

MOL SDF PDB SMILES InChI


  Mrv2104 01022311252D          

 40 45  0  0  1  0            999 V2000
    7.0595    2.6862    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.4128    2.1739    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.5330    1.3577    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.8863    0.8455    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0066    0.0293    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.1193    1.1495    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.9991    1.9656    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
    4.2321    2.2696    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
    3.5400    1.7830    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.3290    1.4503    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.1119    3.0858    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
    4.0262    3.9063    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.3271    3.4764    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
    2.8844    4.2240    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.8888    4.0806    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.7846    2.8845    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
    3.5411    2.5553    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.7215    2.0867    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
    2.6526    1.2646    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.8606    1.9228    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    1.7206    1.1098    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.9976    0.7123    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
    1.0420   -0.1115    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.2361    1.0298    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0095    1.8230    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
   -0.8035    1.9631    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.4884    2.4948    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.3122    2.5392    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
    0.9948    1.7777    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.4842    3.4703    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
    1.9958    4.2186    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.6085    4.9470    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.7215    3.7849    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.0537    3.2093    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.8788    2.7818    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.6458    2.4779    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
    6.2925    2.9901    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.5256    3.2941    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.7586    3.5980    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.6384    4.4142    0.0000 O   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
  4  6  1  0  0  0  0
  7  6  1  0  0  0  0
  7  8  1  0  0  0  0
  8  9  1  0  0  0  0
  8 10  1  1  0  0  0
  8 11  1  0  0  0  0
 11 12  1  6  0  0  0
 11 13  1  0  0  0  0
 13 14  1  0  0  0  0
 13 15  1  6  0  0  0
 13 16  1  0  0  0  0
 16 17  1  6  0  0  0
 16 18  1  0  0  0  0
 18  9  1  0  0  0  0
 18 19  1  6  0  0  0
 18 20  1  0  0  0  0
 20 21  1  0  0  0  0
 22 21  1  0  0  0  0
 22 23  1  6  0  0  0
 22 24  1  0  0  0  0
 25 24  1  0  0  0  0
 25 26  1  6  0  0  0
 25 27  1  0  0  0  0
 28 20  1  0  0  0  0
 28 27  1  0  0  0  0
 28 29  1  6  0  0  0
 28 30  1  0  0  0  0
 30 31  1  0  0  0  0
 14 31  1  0  0  0  0
 31 32  2  0  0  0  0
 30 33  1  6  0  0  0
 30 34  1  0  0  0  0
 16 34  1  0  0  0  0
  7 35  1  6  0  0  0
  7 36  1  0  0  0  0
 36  2  1  0  0  0  0
 36 37  1  1  0  0  0
 36 38  1  0  0  0  0
 38 39  1  0  0  0  0
 11 39  1  0  0  0  0
 39 40  2  0  0  0  0
M  END


  Mrv2104 01022311252D          

 40 45  0  0  1  0            999 V2000
    7.0595    2.6862    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.4128    2.1739    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.5330    1.3577    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.8863    0.8455    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0066    0.0293    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.1193    1.1495    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.9991    1.9656    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
    4.2321    2.2696    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
    3.5400    1.7830    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.3290    1.4503    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.1119    3.0858    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
    4.0262    3.9063    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.3271    3.4764    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
    2.8844    4.2240    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.8888    4.0806    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.7846    2.8845    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
    3.5411    2.5553    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.7215    2.0867    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
    2.6526    1.2646    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.8606    1.9228    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    1.7206    1.1098    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.9976    0.7123    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
    1.0420   -0.1115    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.2361    1.0298    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0095    1.8230    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
   -0.8035    1.9631    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.4884    2.4948    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.3122    2.5392    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
    0.9948    1.7777    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.4842    3.4703    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
    1.9958    4.2186    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.6085    4.9470    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.7215    3.7849    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.0537    3.2093    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.8788    2.7818    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.6458    2.4779    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
    6.2925    2.9901    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.5256    3.2941    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.7586    3.5980    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.6384    4.4142    0.0000 O   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
  4  6  1  0  0  0  0
  7  6  1  0  0  0  0
  7  8  1  0  0  0  0
  8  9  1  0  0  0  0
  8 10  1  1  0  0  0
  8 11  1  0  0  0  0
 11 12  1  6  0  0  0
 11 13  1  0  0  0  0
 13 14  1  0  0  0  0
 13 15  1  6  0  0  0
 13 16  1  0  0  0  0
 16 17  1  6  0  0  0
 16 18  1  0  0  0  0
 18  9  1  0  0  0  0
 18 19  1  6  0  0  0
 18 20  1  0  0  0  0
 20 21  1  0  0  0  0
 22 21  1  0  0  0  0
 22 23  1  6  0  0  0
 22 24  1  0  0  0  0
 25 24  1  0  0  0  0
 25 26  1  6  0  0  0
 25 27  1  0  0  0  0
 28 20  1  0  0  0  0
 28 27  1  0  0  0  0
 28 29  1  6  0  0  0
 28 30  1  0  0  0  0
 30 31  1  0  0  0  0
 14 31  1  0  0  0  0
 31 32  2  0  0  0  0
 30 33  1  6  0  0  0
 30 34  1  0  0  0  0
 16 34  1  0  0  0  0
  7 35  1  6  0  0  0
  7 36  1  0  0  0  0
 36  2  1  0  0  0  0
 36 37  1  1  0  0  0
 36 38  1  0  0  0  0
 38 39  1  0  0  0  0
 11 39  1  0  0  0  0
 39 40  2  0  0  0  0
M  END
> <DATABASE_ID>
NP0351245

> <DATABASE_NAME>
NP-MRD

> <SMILES>
[H][C@@]12C[C@@]3(C)[C@]4([H])CC(C)=CC(=O)[C@@]4([H])CC(=O)[C@]3([H])[C@]3(C)CC(=O)[C@@]([H])(C[C@]13C)[C@]1([H])C[C@@H](C)C[C@@H](O)CN21

> <INCHI_IDENTIFIER>
InChI=1S/C29H41NO4/c1-15-6-17(31)14-30-21(8-15)19-11-28(4)25(30)13-27(3)20-7-16(2)9-22(32)18(20)10-23(33)26(27)29(28,5)12-24(19)34/h9,15,17-21,25-26,31H,6-8,10-14H2,1-5H3/t15-,17+,18-,19-,20+,21-,25+,26-,27-,28+,29-/m0/s1

> <INCHI_KEY>
WHZPPTHDVJNTNO-LXAJEWSXSA-N

> <FORMULA>
C29H41NO4

> <MOLECULAR_WEIGHT>
467.65

> <EXACT_MASS>
467.303558804

> <JCHEM_ACCEPTOR_COUNT>
5

> <JCHEM_ATOM_COUNT>
75

> <JCHEM_AVERAGE_POLARIZABILITY>
52.69781303360726

> <JCHEM_BIOAVAILABILITY>
1

> <JCHEM_DONOR_COUNT>
1

> <JCHEM_FORMAL_CHARGE>
0

> <JCHEM_GHOSE_FILTER>
0

> <JCHEM_IUPAC>
(1R,3S,4R,9S,12S,13S,16S,17S,19R,21R,24S)-21-hydroxy-3,6,13,19,24-pentamethyl-23-azahexacyclo[14.7.2.0^{3,12}.0^{4,9}.0^{13,24}.0^{17,23}]pentacos-6-ene-8,11,15-trione

> <JCHEM_LOGP>
3.606913172999999

> <JCHEM_MDDR_LIKE_RULE>
0

> <JCHEM_NUMBER_OF_RINGS>
6

> <JCHEM_PHYSIOLOGICAL_CHARGE>
1

> <JCHEM_PKA>
18.255661376654114

> <JCHEM_PKA_STRONGEST_ACIDIC>
14.87899302546833

> <JCHEM_PKA_STRONGEST_BASIC>
10.12689333209517

> <JCHEM_POLAR_SURFACE_AREA>
74.68

> <JCHEM_REFRACTIVITY>
131.52709999999996

> <JCHEM_ROTATABLE_BOND_COUNT>
0

> <JCHEM_RULE_OF_FIVE>
1

> <JCHEM_TRADITIONAL_IUPAC>
(1R,3S,4R,9S,12S,13S,16S,17S,19R,21R,24S)-21-hydroxy-3,6,13,19,24-pentamethyl-23-azahexacyclo[14.7.2.0^{3,12}.0^{4,9}.0^{13,24}.0^{17,23}]pentacos-6-ene-8,11,15-trione

> <JCHEM_VEBER_RULE>
0

$$$$

HEADER    PROTEIN                                 02-JAN-23   NONE
TITLE     NULL                                                        
COMPND    NULL                                                        
SOURCE    NULL                                                        
KEYWDS    NULL                                                        
EXPDTA    NULL                                                        
AUTHOR    Marvin                                                      
REVDAT   1   02-JAN-23         0                                  
HETATM    1  O   UNK     0      13.178   5.014   0.000  0.00  0.00           O+0
HETATM    2  C   UNK     0      11.971   4.058   0.000  0.00  0.00           C+0
HETATM    3  C   UNK     0      12.195   2.534   0.000  0.00  0.00           C+0
HETATM    4  C   UNK     0      10.988   1.578   0.000  0.00  0.00           C+0
HETATM    5  C   UNK     0      11.212   0.055   0.000  0.00  0.00           C+0
HETATM    6  C   UNK     0       9.556   2.146   0.000  0.00  0.00           C+0
HETATM    7  C   UNK     0       9.332   3.669   0.000  0.00  0.00           C+0
HETATM    8  C   UNK     0       7.900   4.237   0.000  0.00  0.00           C+0
HETATM    9  C   UNK     0       6.608   3.328   0.000  0.00  0.00           C+0
HETATM   10  C   UNK     0       8.081   2.707   0.000  0.00  0.00           C+0
HETATM   11  C   UNK     0       7.676   5.760   0.000  0.00  0.00           C+0
HETATM   12  H   UNK     0       7.516   7.292   0.000  0.00  0.00           H+0
HETATM   13  C   UNK     0       6.211   6.489   0.000  0.00  0.00           C+0
HETATM   14  C   UNK     0       5.384   7.885   0.000  0.00  0.00           C+0
HETATM   15  C   UNK     0       7.259   7.617   0.000  0.00  0.00           C+0
HETATM   16  C   UNK     0       5.198   5.384   0.000  0.00  0.00           C+0
HETATM   17  C   UNK     0       6.610   4.770   0.000  0.00  0.00           C+0
HETATM   18  C   UNK     0       5.080   3.895   0.000  0.00  0.00           C+0
HETATM   19  H   UNK     0       4.952   2.361   0.000  0.00  0.00           H+0
HETATM   20  N   UNK     0       3.473   3.589   0.000  0.00  0.00           N+0
HETATM   21  C   UNK     0       3.212   2.072   0.000  0.00  0.00           C+0
HETATM   22  C   UNK     0       1.862   1.330   0.000  0.00  0.00           C+0
HETATM   23  O   UNK     0       1.945  -0.208   0.000  0.00  0.00           O+0
HETATM   24  C   UNK     0       0.441   1.922   0.000  0.00  0.00           C+0
HETATM   25  C   UNK     0       0.018   3.403   0.000  0.00  0.00           C+0
HETATM   26  C   UNK     0      -1.500   3.664   0.000  0.00  0.00           C+0
HETATM   27  C   UNK     0       0.912   4.657   0.000  0.00  0.00           C+0
HETATM   28  C   UNK     0       2.449   4.740   0.000  0.00  0.00           C+0
HETATM   29  H   UNK     0       1.857   3.318   0.000  0.00  0.00           H+0
HETATM   30  C   UNK     0       2.770   6.478   0.000  0.00  0.00           C+0
HETATM   31  C   UNK     0       3.725   7.875   0.000  0.00  0.00           C+0
HETATM   32  O   UNK     0       3.003   9.234   0.000  0.00  0.00           O+0
HETATM   33  H   UNK     0       1.347   7.065   0.000  0.00  0.00           H+0
HETATM   34  C   UNK     0       3.834   5.991   0.000  0.00  0.00           C+0
HETATM   35  H   UNK     0       9.107   5.193   0.000  0.00  0.00           H+0
HETATM   36  C   UNK     0      10.539   4.625   0.000  0.00  0.00           C+0
HETATM   37  H   UNK     0      11.746   5.582   0.000  0.00  0.00           H+0
HETATM   38  C   UNK     0      10.314   6.149   0.000  0.00  0.00           C+0
HETATM   39  C   UNK     0       8.883   6.716   0.000  0.00  0.00           C+0
HETATM   40  O   UNK     0       8.658   8.240   0.000  0.00  0.00           O+0
CONECT    1    2                                                            
CONECT    2    1    3   36                                                  
CONECT    3    2    4                                                       
CONECT    4    3    5    6                                                  
CONECT    5    4                                                            
CONECT    6    4    7                                                       
CONECT    7    6    8   35   36                                             
CONECT    8    7    9   10   11                                             
CONECT    9    8   18                                                       
CONECT   10    8                                                            
CONECT   11    8   12   13   39                                             
CONECT   12   11                                                            
CONECT   13   11   14   15   16                                             
CONECT   14   13   31                                                       
CONECT   15   13                                                            
CONECT   16   13   17   18   34                                             
CONECT   17   16                                                            
CONECT   18   16    9   19   20                                             
CONECT   19   18                                                            
CONECT   20   18   21   28                                                  
CONECT   21   20   22                                                       
CONECT   22   21   23   24                                                  
CONECT   23   22                                                            
CONECT   24   22   25                                                       
CONECT   25   24   26   27                                                  
CONECT   26   25                                                            
CONECT   27   25   28                                                       
CONECT   28   20   27   29   30                                             
CONECT   29   28                                                            
CONECT   30   28   31   33   34                                             
CONECT   31   30   14   32                                                  
CONECT   32   31                                                            
CONECT   33   30                                                            
CONECT   34   30   16                                                       
CONECT   35    7                                                            
CONECT   36    7    2   37   38                                             
CONECT   37   36                                                            
CONECT   38   36   39                                                       
CONECT   39   38   11   40                                                  
CONECT   40   39                                                            
MASTER        0    0    0    0    0    0    0    0   40    0   90    0
END

View in JSmol

Synonyms

Not Available

Chemical Formula

C₂₉H₄₁NO₄

Average Mass

467.6500 Da

Monoisotopic Mass

467.30356 Da

IUPAC Name

(1R,3S,4R,9S,12S,13S,16S,17S,19R,21R,24S)-21-hydroxy-3,6,13,19,24-pentamethyl-23-azahexacyclo[14.7.2.0^{3,12}.0^{4,9}.0^{13,24}.0^{17,23}]pentacos-6-ene-8,11,15-trione

Traditional Name

(1R,3S,4R,9S,12S,13S,16S,17S,19R,21R,24S)-21-hydroxy-3,6,13,19,24-pentamethyl-23-azahexacyclo[14.7.2.0^{3,12}.0^{4,9}.0^{13,24}.0^{17,23}]pentacos-6-ene-8,11,15-trione

CAS Registry Number

Not Available

SMILES

[H][C@@]12C[C@@]3(C)[C@]4([H])CC(C)=CC(=O)[C@@]4([H])CC(=O)[C@]3([H])[C@]3(C)CC(=O)[C@@]([H])(C[C@]13C)[C@]1([H])C[C@@H](C)C[C@@H](O)CN21

InChI Identifier

InChI=1S/C29H41NO4/c1-15-6-17(31)14-30-21(8-15)19-11-28(4)25(30)13-27(3)20-7-16(2)9-22(32)18(20)10-23(33)26(27)29(28,5)12-24(19)34/h9,15,17-21,25-26,31H,6-8,10-14H2,1-5H3/t15-,17+,18-,19-,20+,21-,25+,26-,27-,28+,29-/m0/s1

InChI Key

WHZPPTHDVJNTNO-LXAJEWSXSA-N

Experimental Spectra

Spectrum Type	Description	Depositor Email	Depositor Organization	Depositor	Deposition Date	View
HSQC NMR	[¹H, ¹³C] NMR Spectrum (2D, 600 MHz, CDCl3, experimental)	kueihunglai@tmu.edu.tw	Taipei Medical University	Kuei-Hung Lai	2025-06-25	View Spectrum
HMBC NMR	[¹H, ¹³C] NMR Spectrum (2D, 600 MHz, CDCl3, experimental)	kueihunglai@tmu.edu.tw	Taipei Medical University	Kuei-Hung Lai	2025-06-25	View Spectrum
NOESY NMR	[¹H, ¹H] NMR Spectrum (2D, 600 MHz, CDCl3, experimental)	kueihunglai@tmu.edu.tw	Taipei Medical University	Kuei-Hung Lai	2025-06-25	View Spectrum
1D_DEPT NMR	¹³C NMR Spectrum (1D, 151 MHz, CDCl3, experimental)	kueihunglai@tmu.edu.tw	Taipei Medical University	Kuei-Hung Lai	2025-06-25	View Spectrum
COSY NMR	[¹H, ¹H] NMR Spectrum (2D, 600 MHz, CDCl3, experimental)	kueihunglai@tmu.edu.tw	Taipei Medical University	Kuei-Hung Lai	2025-06-25	View Spectrum
1D_DEPT NMR	¹³C NMR Spectrum (1D, 151 MHz, CDCl3, experimental)	kueihunglai@tmu.edu.tw	Taipei Medical University	Kuei-Hung Lai	2025-06-25	View Spectrum
1D NMR	¹H NMR Spectrum (1D, 600 MHz, CDCl3, experimental)	kueihunglai@tmu.edu.tw	Taipei Medical University	Kuei-Hung Lai	2025-06-25	View Spectrum
1D NMR	¹³C NMR Spectrum (1D, 151 MHz, CDCl3, experimental)	kueihunglai@tmu.edu.tw	Taipei Medical University	Kuei-Hung Lai	2025-06-25	View Spectrum

Predicted Spectra

Not Available

Chemical Shift Submissions

Not Available

Species

Species of Origin

Species Name	Source	Reference
Zoanthus kuroshio		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	3.61	ChemAxon
pKa (Strongest Acidic)	14.88	ChemAxon
pKa (Strongest Basic)	10.13	ChemAxon
Physiological Charge	1	ChemAxon
Hydrogen Acceptor Count	5	ChemAxon
Hydrogen Donor Count	1	ChemAxon
Polar Surface Area	74.68 Å²	ChemAxon
Rotatable Bond Count	0	ChemAxon
Refractivity	131.53 m³·mol⁻¹	ChemAxon
Polarizability	52.7 Å³	ChemAxon
Number of Rings	6	ChemAxon
Bioavailability	Yes	ChemAxon
Rule of Five	Yes	ChemAxon
Ghose Filter	No	ChemAxon
Veber's Rule	No	ChemAxon
MDDR-like Rule	No	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

Pham NT, Peng BR, Le HG, Cheng YS, Chen YS, Huynh TH, Chen LY, Nguyen LAT, Nguyen DT, Chang YC, Su JH, El-Shazly M, Lee MH, Lai KH: Zoanthamine-Type Alkaloids Derived from Cultured Zoanthus kuroshio with Therapeutic Potential Against Osteoporosis. J Nat Prod. 2025 Jun 9. doi: 10.1021/acs.jnatprod.5c00457. [PubMed:40490901 ]
DOI: 10.1021/acs.jnatprod.5c00457
PMID: 40490901

Showing NP-Card for Norzoazepanol (NP0351245)

MOL for NP0351245 (Norzoazepanol)

3D MOL for NP0351245 (Norzoazepanol)

3D SDF for NP0351245 (Norzoazepanol)

3D-SDF for NP0351245 (Norzoazepanol)

PDB for NP0351245 (Norzoazepanol)

3D PDB for NP0351245 (Norzoazepanol)

SMILES for NP0351245 (Norzoazepanol)

INCHI for NP0351245 (Norzoazepanol)

Structure for NP0351245 (Norzoazepanol)

3D Structure for NP0351245 (Norzoazepanol)