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(Q104987057)
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English
1,4a,6a,6b,9,9,12a-Heptamethyl-10-oxo-1,2,3,4,5,6,6a,7,8,8a,11,12,13,14b-tetradecahydropicene-2-carboxylic acid
group of stereoisomers with the chemical formula C₃₀H₄₆O₃
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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
454.344695332
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₃₀H₄₆O₃
0 references
canonical SMILES
O=C(O)C1CCC2(C)CCC3(C(=CCC4C5(C)CCC(=O)C(C)(C)C5CCC43C)C2C1C)C
0 references
found in taxon
Scoparia dulcis
1 reference
stated in
6-methoxybenzoxazolinone and triterpenoids from roots of Scoparia dulcis
Identifiers
InChI
InChI=1S/C30H46O3/c1-18-19(25(32)33)10-13-27(4)16-17-29(6)20(24(18)27)8-9-22-28(5)14-12-23(31)26(2,3)21(28)11-15-30(22,29)7/h8,18-19,21-22,24H,9-17H2,1-7H3,(H,32,33)
0 references
InChIKey
DQOFFNPCGATPDE-UHFFFAOYSA-N
0 references
PubChem CID
3640008
2 references
stated in
PubChem
retrieved
26 December 2021
inferred from
InChIKey
matched by identifier from
InChIKey
InChIKey
DQOFFNPCGATPDE-UHFFFAOYSA-N
UniChem compound ID
61279044
1 reference
stated in
UniChem
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