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(Q105210241)
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English
[13-Acetyloxy-1-hydroxy-8,12-bis(hydroxymethyl)-4,12,15-trimethyl-5-oxo-14-tetracyclo[8.5.0.02,6.011,13]pentadeca-3,8-dienyl] deca-2,4-dienoate
group of stereoisomers with the chemical formula C₃₂H₄₄O₈
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Statements
instance of
group of stereoisomers
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subclass of
tigliane diterpenoid
1 reference
inferred from
tigliane diterpenoid
mass
556.3036183679998
dalton
1 reference
based on heuristic
inferred from InChI
chemical formula
C₃₂H₄₄O₈
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canonical SMILES
O=C(OC1C(C)C2(O)C3C=C(C(=O)C3CC(=CC2C4C1(OC(=O)C)C4(C)CO)CO)C)C=CC=CCCCCC
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Identifiers
InChI
InChI=1S/C32H44O8/c1-6-7-8-9-10-11-12-13-26(36)39-29-20(3)31(38)24-14-19(2)27(37)23(24)15-22(17-33)16-25(31)28-30(5,18-34)32(28,29)40-21(4)35/h10-14,16,20,23-25,28-29,33-34,38H,6-9,15,17-18H2,1-5H3
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InChIKey
PJYZDBMCXHYHRX-UHFFFAOYSA-N
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PubChem CID
163011202
2 references
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
PJYZDBMCXHYHRX-UHFFFAOYSA-N
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