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(Q104967963)
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English
3-O-[[7-hydroxy-5-[2-(5-methoxyoxolan-3-yl)ethyl]-5,6,8a-trimethyl-3,4,4a,6,7,8-hexahydronaphthalen-1-yl]methyl] 1-O-methyl propanedioate
group of stereoisomers with the chemical formula C₂₅H₄₀O₇
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Statements
instance of
group of stereoisomers
0 references
subclass of
clerodane diterpenoid
1 reference
inferred from
clerodane diterpenoid
mass
452.2774036199998
dalton
1 reference
based on heuristic
inferred from InChI
chemical formula
C₂₅H₄₀O₇
0 references
canonical SMILES
O=C(OC)CC(=O)OCC1=CCCC2C1(C)CC(O)C(C)C2(C)CCC3COC(OC)C3
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Identifiers
InChI
InChI=1S/C25H40O7/c1-16-19(26)13-25(3)18(15-31-22(28)12-21(27)29-4)7-6-8-20(25)24(16,2)10-9-17-11-23(30-5)32-14-17/h7,16-17,19-20,23,26H,6,8-15H2,1-5H3
0 references
InChIKey
CQFSHGWFBAMTPO-UHFFFAOYSA-N
0 references
PubChem CID
163045557
2 references
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
CQFSHGWFBAMTPO-UHFFFAOYSA-N
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