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(Q105244090)
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English
28-Glucosylpomolate
group of stereoisomers with the chemical formula C₃₆H₅₈O₉
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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
634.408083436
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₃₆H₅₈O₉
0 references
canonical SMILES
O=C(OC1OC(CO)C(O)C(O)C1O)C23CCC(C)C(O)(C)C3C4=CCC5C6(C)CCC(O)C(C)(C)C6CCC5(C)C4(C)CC2
0 references
Identifiers
InChI
InChI=1S/C36H58O9/c1-19-10-15-36(30(42)45-29-27(41)26(40)25(39)21(18-37)44-29)17-16-33(5)20(28(36)35(19,7)43)8-9-23-32(4)13-12-24(38)31(2,3)22(32)11-14-34(23,33)6/h8,19,21-29,37-41,43H,9-18H2,1-7H3
0 references
InChIKey
RRIMLWHUVCZACL-UHFFFAOYSA-N
0 references
PubChem CID
76155900
2 references
stated in
PubChem
retrieved
17 September 2022
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
RRIMLWHUVCZACL-UHFFFAOYSA-N
ChEBI ID
176266
mapping relation type
exact match
2 references
stated in
ChEBI release 2022-06-13
matched by identifier from
International Chemical Identifier
InChI
InChI=1S/C36H58O9/c1-19-10-15-36(30(42)45-29-27(41)26(40)25(39)21(18-37)44-29)17-16-33(5)20(28(36)35(19,7)43)8-9-23-32(4)13-12-24(38)31(2,3)22(32)11-14-34(23,33)6/h8,19,21-29,37-41,43H,9-18H2,1-7H3
UniChem compound ID
32019965
1 reference
stated in
UniChem
Human Metabolome Database ID
HMDB0038452
2 references
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
RRIMLWHUVCZACL-UHFFFAOYSA-N
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