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(Q105243813)
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English
Tormentic acid, methyl ester
group of stereoisomers with the chemical formula C₃₁H₅₀O₅
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Statements
instance of
group of stereoisomers
0 references
subclass of
taraxastane / ursane triterpenoid
1 reference
inferred from
taraxastane / ursane triterpenoid
mass
502.36582469999985
dalton
1 reference
based on heuristic
inferred from InChI
chemical formula
C₃₁H₅₀O₅
0 references
canonical SMILES
O=C(OC)C12CCC(C)C(O)(C)C2C3=CCC4C5(C)CC(O)C(O)C(C)(C)C5CCC4(C)C3(C)CC1
0 references
Identifiers
InChI
InChI=1S/C31H50O5/c1-18-11-14-31(25(34)36-8)16-15-28(5)19(23(31)30(18,7)35)9-10-22-27(4)17-20(32)24(33)26(2,3)21(27)12-13-29(22,28)6/h9,18,20-24,32-33,35H,10-17H2,1-8H3
0 references
InChIKey
RQWXHGLRDYGNGZ-UHFFFAOYSA-N
0 references
PubChem CID
601648
2 references
stated in
PubChem
retrieved
26 December 2021
inferred from
InChIKey
matched by identifier from
InChIKey
InChIKey
RQWXHGLRDYGNGZ-UHFFFAOYSA-N
UniChem compound ID
58282041
1 reference
stated in
UniChem
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