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(Q105221175)
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English
6-(3,7-Dihydroxy-3,7-dimethyloctyl)-1,3,5-trihydroxy-2-(4-hydroxy-3-methylbut-2-enyl)-7-methoxyxanthen-9-one
group of stereoisomers with the chemical formula C₂₉H₃₈O₉
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Statements
instance of
group of stereoisomers
0 references
subclass of
2,6-dimethyloctane monoterpenoid
1 reference
inferred from
2,6-dimethyloctane monoterpenoid
biogenic xanthone
1 reference
inferred from
biogenic xanthone
mass
530.2515827959998
dalton
1 reference
based on heuristic
inferred from InChI
chemical formula
C₂₉H₃₈O₉
0 references
canonical SMILES
O=C1C2=CC(OC)=C(C(O)=C2OC3=CC(O)=C(C(O)=C13)CC=C(C)CO)CCC(O)(C)CCCC(O)(C)C
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Identifiers
InChI
InChI=1S/C29H38O9/c1-16(15-30)7-8-17-20(31)14-22-23(24(17)32)25(33)19-13-21(37-5)18(26(34)27(19)38-22)9-12-29(4,36)11-6-10-28(2,3)35/h7,13-14,30-32,34-36H,6,8-12,15H2,1-5H3
0 references
InChIKey
QHWGCVYVZATLQE-UHFFFAOYSA-N
0 references
PubChem CID
75082430
2 references
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
QHWGCVYVZATLQE-UHFFFAOYSA-N
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