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(Q110193992)
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English
Kaura-16-ene-7alpha,19-diol 19-acetate
chemical compound
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Statements
instance of
type of chemical entity
0 references
subclass of
kaurane diterpenoid
1 reference
based on heuristic
inferred from SMILES
mass
346.250794948
dalton
1 reference
based on heuristic
inferred from SMILES
stereoisomer of
ent-7alpha-hydroxy-18-acetoxykaur-16-ene
2 references
based on heuristic
inferred from InChIKey
based on heuristic
inferred from InChI
[(1R,2S,4R,5S,9R,10S,13R)-2-hydroxy-5,9-dimethyl-14-methylidene-5-tetracyclo[11.2.1.01,10.04,9]hexadecanyl]methyl acetate
2 references
based on heuristic
inferred from InChIKey
based on heuristic
inferred from InChI
(4S)-Kaur-16-ene-7beta,19-diol 19-acetate
1 reference
based on heuristic
inferred from InChI
[(1S,2R,4R,5R,9S,10R,13S)-2-hydroxy-5,9-dimethyl-14-methylidene-5-tetracyclo[11.2.1.01,10.04,9]hexadecanyl]methyl acetate
1 reference
based on heuristic
inferred from InChI
chemical formula
C₂₂H₃₄O₃
0 references
canonical SMILES
O=C(OCC1(C)CCCC2(C)C3CCC4C(=C)CC3(C4)C(O)CC12)C
0 references
isomeric SMILES
C=C1C[C@]23C[C@H]1CC[C@H]2[C@]1(C)CCC[C@](C)(COC(C)=O)[C@H]1C[C@H]3O
0 references
found in taxon
Croton kongensis
1 reference
stated in
ent-Kaurane diterpenoids from Croton tonkinensis stimulate osteoblast differentiation
Identifiers
InChI
InChI=1S/C22H34O3/c1-14-11-22-12-16(14)6-7-17(22)21(4)9-5-8-20(3,13-25-15(2)23)18(21)10-19(22)24/h16-19,24H,1,5-13H2,2-4H3/t16-,17+,18-,19-,20-,21+,22+/m1/s1
0 references
InChIKey
DVQAFABFSBJZIB-LTABAFLCSA-N
0 references
PubChem CID
56926021
2 references
stated in
PubChem
retrieved
17 September 2022
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
DVQAFABFSBJZIB-LTABAFLCSA-N
UniChem compound ID
27241752
1 reference
stated in
UniChem
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