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(Q104400176)
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English
10-Hydroxy-6a-[3-(4-hydroxyphenyl)prop-2-enoyloxymethyl]-2,2,6b,9,9,12a-hexamethyl-1,3,4,5,6,6a,7,8,8a,10,11,12,13,14b-tetradecahydropicene-4a-carboxylic acid
group of stereoisomers with the chemical formula C₃₉H₅₄O₆
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Statements
instance of
group of stereoisomers
0 references
subclass of
oleanane triterpenoid
1 reference
inferred from
oleanane triterpenoid
mass
618.3920394480001
dalton
1 reference
based on heuristic
inferred from InChI
chemical formula
C₃₉H₅₄O₆
0 references
canonical SMILES
O=C(OCC12C(=CCC3C4(C)CCC(O)C(C)(C)C4CCC31C)C5CC(C)(C)CCC5(C(=O)O)CC2)C=CC6=CC=C(O)C=C6
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Identifiers
InChI
InChI=1S/C39H54O6/c1-34(2)19-20-38(33(43)44)21-22-39(24-45-32(42)14-9-25-7-10-26(40)11-8-25)27(28(38)23-34)12-13-30-36(5)17-16-31(41)35(3,4)29(36)15-18-37(30,39)6/h7-12,14,28-31,40-41H,13,15-24H2,1-6H3,(H,43,44)
0 references
InChIKey
ZPBONBNZOMMCQS-UHFFFAOYSA-N
0 references
PubChem CID
73088392
2 references
stated in
PubChem
retrieved
26 December 2021
inferred from
InChIKey
matched by identifier from
InChIKey
InChIKey
ZPBONBNZOMMCQS-UHFFFAOYSA-N
UniChem compound ID
69827497
1 reference
stated in
UniChem
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