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(Q104958971)
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English
5-[2-(6-Methoxy-7,7,12,16-tetramethyl-15-pentacyclo[9.7.0.01,3.03,8.012,16]octadecanyl)propyl]-3-methyloxolan-2-one
group of stereoisomers with the chemical formula C₃₁H₅₀O₃
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Statements
instance of
group of stereoisomers
0 references
subclass of
cycloartane triterpenoid
1 reference
inferred from
cycloartane triterpenoid
mass
470.3759954599999
dalton
1 reference
based on heuristic
inferred from InChI
chemical formula
C₃₁H₅₀O₃
0 references
canonical SMILES
O=C1OC(CC1C)CC(C)C2CCC3(C)C4CCC5C(C)(C)C(OC)CCC65CC46CCC23C
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Identifiers
InChI
InChI=1S/C31H50O3/c1-19(16-21-17-20(2)26(32)34-21)22-10-12-29(6)24-9-8-23-27(3,4)25(33-7)11-13-30(23)18-31(24,30)15-14-28(22,29)5/h19-25H,8-18H2,1-7H3
0 references
InChIKey
CHKLCIOPOJVAIZ-UHFFFAOYSA-N
0 references
PubChem CID
162872595
2 references
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
CHKLCIOPOJVAIZ-UHFFFAOYSA-N
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