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(Q105215103)
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English
2-[5-[4-hydroxy-5,8a-dimethyl-2-methylidene-5-[[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxymethyl]-3,4,4a,6,7,8-hexahydro-1H-naphthalen-1-yl]-3-methylpent-2-enoxy]-6-methyloxane-3,4,5-triol
group of stereoisomers with the chemical formula C₃₂H₅₄O₁₂
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Statements
instance of
group of stereoisomers
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subclass of
labdanes
1 reference
inferred from
labdanes
mass
630.361527168
dalton
1 reference
based on heuristic
inferred from InChI
chemical formula
C₃₂H₅₄O₁₂
0 references
canonical SMILES
OCC1OC(OCC2(C)CCCC3(C)C(C(=C)CC(O)C23)CCC(=CCOC4OC(C)C(O)C(O)C4O)C)C(O)C(O)C1O
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Identifiers
InChI
InChI=1S/C32H54O12/c1-16(9-12-41-29-26(39)24(37)22(35)18(3)43-29)7-8-19-17(2)13-20(34)28-31(4,10-6-11-32(19,28)5)15-42-30-27(40)25(38)23(36)21(14-33)44-30/h9,18-30,33-40H,2,6-8,10-15H2,1,3-5H3
0 references
InChIKey
PUHVSLQDLDYLBX-UHFFFAOYSA-N
0 references
PubChem CID
162931637
1 reference
based on heuristic
inferred from InChIKey
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