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(Q104987609)
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English
DRSIUFQRQCNVHS-UHFFFAOYSA-N
group of stereoisomers with the chemical formula C₄₈H₇₈O₁₈
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Statements
instance of
group of stereoisomers
0 references
subclass of
cucurbitane triterpenoid
1 reference
inferred from
cucurbitane triterpenoid
mass
942.5188156560006
dalton
1 reference
based on heuristic
inferred from InChI
chemical formula
C₄₈H₇₈O₁₈
0 references
canonical SMILES
O=C1CC2(C)C(CCC2(C)C3CC=C4C(CCC(OC5OC(CO)C(O)C(O)C5O)C4(C)C)C13C)C(C)CCC=C(C)COC6OC(CO)C(O)C(O)C6OC7OC(CO)C(O)C(O)C7O
0 references
Identifiers
InChI
InChI=1S/C48H78O18/c1-22(21-61-44-41(38(58)35(55)29(20-51)64-44)66-43-40(60)37(57)34(54)28(19-50)63-43)9-8-10-23(2)24-15-16-46(5)30-13-11-25-26(48(30,7)31(52)17-47(24,46)6)12-14-32(45(25,3)4)65-42-39(59)36(56)33(53)27(18-49)62-42/h9,11,23-24,26-30,32-44,49-51,53-60H,8,10,12-21H2,1-7H3
0 references
InChIKey
DRSIUFQRQCNVHS-UHFFFAOYSA-N
0 references
PubChem CID
73813203
2 references
stated in
PubChem
inferred from
InChIKey
retrieved
15 September 2022
matched by identifier from
InChIKey
InChIKey
DRSIUFQRQCNVHS-UHFFFAOYSA-N
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