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(Q105381396)
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English
5-[2-hydroxy-2,5,8a-trimethyl-5-(3-methylbut-2-enoyloxymethyl)-3,4,4a,6,7,8-hexahydro-1H-naphthalen-1-yl]-3-methylpentanoic acid
group of stereoisomers with the chemical formula C₂₅H₄₂O₅
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Statements
instance of
group of stereoisomers
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subclass of
labdanes
1 reference
inferred from
labdanes
mass
422.30322444399985
dalton
1 reference
based on heuristic
inferred from InChI
chemical formula
C₂₅H₄₂O₅
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canonical SMILES
O=C(OCC1(C)CCCC2(C)C(CCC(C)CC(=O)O)C(O)(C)CCC12)C=C(C)C
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Identifiers
InChI
InChI=1S/C25H42O5/c1-17(2)14-22(28)30-16-23(4)11-7-12-24(5)19(23)10-13-25(6,29)20(24)9-8-18(3)15-21(26)27/h14,18-20,29H,7-13,15-16H2,1-6H3,(H,26,27)
0 references
InChIKey
ZQCLFYPJCVYMSK-UHFFFAOYSA-N
0 references
PubChem CID
163017774
1 reference
based on heuristic
inferred from InChIKey
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