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(Q105288363)
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English
(1S,2R,4aS,6aS,6bR,10S,12aR,12bR,14bS)-10-Hydroxy-1,2,6a,6b,9,9,12a-heptamethyl-1,2,3,4,4a,5,6,6a,6b,7,8,8a,9,10,11,12,12a,12b,13,14b-icosahydropicene-4a-carbaldehyde
group of stereoisomers with the chemical formula C₃₀H₄₈O₂
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Statements
instance of
group of stereoisomers
0 references
subclass of
taraxastane / ursane triterpenoid
1 reference
inferred from
taraxastane / ursane triterpenoid
mass
440.365430776
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₃₀H₄₈O₂
0 references
canonical SMILES
O=CC12CCC(C)C(C)C2C3=CCC4C5(C)CCC(O)C(C)(C)C5CCC4(C)C3(C)CC1
0 references
Identifiers
InChI
InChI=1S/C30H48O2/c1-19-10-15-30(18-31)17-16-28(6)21(25(30)20(19)2)8-9-23-27(5)13-12-24(32)26(3,4)22(27)11-14-29(23,28)7/h8,18-20,22-25,32H,9-17H2,1-7H3
0 references
InChIKey
VLFUANNVMXKBPF-UHFFFAOYSA-N
0 references
PubChem CID
14423519
2 references
stated in
PubChem
retrieved
17 September 2022
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
VLFUANNVMXKBPF-UHFFFAOYSA-N
UniChem compound ID
69876272
1 reference
stated in
UniChem
Human Metabolome Database ID
HMDB0303442
2 references
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
VLFUANNVMXKBPF-UHFFFAOYSA-N
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