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(Q105179737)
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English
(1S,4S,5R,9S,10S,13R,14S)-14-(hydroxymethyl)-5,9-dimethyltetracyclo[11.2.1.01,10.04,9]hexadecane-5,14-diol
chemical compound
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Statements
instance of
type of chemical entity
0 references
subclass of
19-Nor-ent-kaurane-4alpha,16beta,17-triol
1 reference
based on heuristic
inferred from SMILES
19-Norkaurane-4alpha,16alpha,17-triol
1 reference
based on heuristic
inferred from SMILES
mass
308.235144884
dalton
1 reference
based on heuristic
inferred from SMILES
stereoisomer of
CID 10518902
1 reference
based on heuristic
inferred from InChI
chemical formula
C₁₉H₃₂O₃
0 references
canonical SMILES
OCC1(O)CC23CCC4C(O)(C)CCCC4(C)C3CCC1C2
0 references
isomeric SMILES
C[C@@]12CCC[C@@](C)(O)[C@H]1CC[C@@]13C[C@@H](CC[C@@H]12)[C@](O)(CO)C3
0 references
found in taxon
Annona squamosa
1 reference
stated in
New ent-kaurane diterpenoids with anti-platelet aggregation activity from Annona squamosa.
Identifiers
InChI
InChI=1S/C19H32O3/c1-16-7-3-8-17(2,21)14(16)6-9-18-10-13(4-5-15(16)18)19(22,11-18)12-20/h13-15,20-22H,3-12H2,1-2H3/t13-,14+,15-,16-,17-,18+,19-/m1/s1
0 references
InChIKey
NICDFCNOCPZHTJ-PPXQIISCSA-N
0 references
PubChem CID
15275079
2 references
stated in
PubChem
retrieved
17 September 2022
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
NICDFCNOCPZHTJ-PPXQIISCSA-N
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