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(Q104945408)
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Anominine
chemical compound
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Statements
instance of
type of chemical entity
0 references
subclass of
8-(1H-Indol-3-ylmethyl)-4,4a-dimethyl-7-methylene-8a-(4-methyl-3-pentenyl)decahydro-1-naphthalenol
1 reference
based on heuristic
inferred from SMILES
CID 11969862
1 reference
based on heuristic
inferred from SMILES
mass
405.303164868
dalton
1 reference
based on heuristic
inferred from SMILES
stereoisomer of
Nominine
1 reference
based on heuristic
inferred from InChI
chemical formula
C₂₈H₃₉NO
0 references
canonical SMILES
OC1CCC(C)C2(C)CCC(=C)C(CC3=CNC=4C=CC=CC43)C12CCC=C(C)C
0 references
isomeric SMILES
C=C1CC[C@@]2(C)[C@H](C)CC[C@H](O)[C@@]2(CCC=C(C)C)[C@@H]1Cc1c[nH]c2ccccc12
0 references
found in taxon
Aspergillus nomius
1 reference
stated in
Nominine: a new insecticidal indole diterpene from the sclerotia of Aspergillus nomius
Identifiers
InChI
InChI=1S/C28H39NO/c1-19(2)9-8-15-28-24(17-22-18-29-25-11-7-6-10-23(22)25)20(3)14-16-27(28,5)21(4)12-13-26(28)30/h6-7,9-11,18,21,24,26,29-30H,3,8,12-17H2,1-2,4-5H3/t21-,24-,26+,27+,28-/m1/s1
0 references
InChIKey
BSSPRCKKWJRAJZ-LSKARBNJSA-N
0 references
PubChem CID
11961129
1 reference
stated in
PubChem
retrieved
17 September 2022
based on heuristic
inferred from InChIKey
ChEBI ID
211800
mapping relation type
exact match
1 reference
matched by identifier from
International Chemical Identifier
InChI
InChI=1S/C28H39NO/c1-19(2)9-8-15-28-24(17-22-18-29-25-11-7-6-10-23(22)25)20(3)14-16-27(28,5)21(4)12-13-26(28)30/h6-7,9-11,18,21,24,26,29-30H,3,8,12-17H2,1-2,4-5H3/t21-,24-,26+,27+,28-/m1/s1
UniChem compound ID
32956545
1 reference
stated in
UniChem
Natural Product Atlas ID
NPA018815
2 references
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
BSSPRCKKWJRAJZ-LSKARBNJSA-N
Probes And Drugs ID
PD143335
0 references
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