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(Q105174888)
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English
3,4,10-Trihydroxy-2,2,6a,6b,9,9,12a-heptamethyl-1,3,4,5,6,6a,7,8,8a,10,11,12-dodecahydropicene-4a-carboxylic acid
group of stereoisomers with the chemical formula C₃₀H₄₆O₅
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Statements
instance of
group of stereoisomers
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subclass of
oleanane triterpenoid
1 reference
inferred from
oleanane triterpenoid
mass
486.33452457199985
dalton
1 reference
based on heuristic
inferred from InChI
chemical formula
C₃₀H₄₆O₅
0 references
canonical SMILES
O=C(O)C12C(=C3C=CC4C5(C)CCC(O)C(C)(C)C5CCC4(C)C3(C)CC1)CC(C)(C)C(O)C2O
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Identifiers
InChI
InChI=1S/C30H46O5/c1-25(2)16-18-17-8-9-20-27(5)12-11-21(31)26(3,4)19(27)10-13-29(20,7)28(17,6)14-15-30(18,24(34)35)23(33)22(25)32/h8-9,19-23,31-33H,10-16H2,1-7H3,(H,34,35)
0 references
InChIKey
MYGUWXUCQPPVCP-UHFFFAOYSA-N
0 references
PubChem CID
162955549
1 reference
based on heuristic
inferred from InChIKey
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