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(Q105351631)
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English
(3,4,5-Trihydroxyoxan-2-yl) 2,3,5-trihydroxy-8a-(hydroxymethyl)-4,6a,6b,11,11,14b-hexamethyl-1,2,3,4a,5,6,7,8,9,10,12,12a,14,14a-tetradecahydropicene-4-carboxylate
group of stereoisomers with the chemical formula C₃₅H₅₆O₁₀
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Statements
instance of
group of stereoisomers
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subclass of
oleanane triterpenoid
1 reference
inferred from
oleanane triterpenoid
mass
636.8145
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₃₅H₅₆O₁₀
0 references
canonical SMILES
O=C(OC1OCC(O)C(O)C1O)C2(C)C(O)C(O)CC3(C)C4CC=C5C6CC(C)(C)CCC6(CO)CCC5(C)C4(C)CC(O)C23
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Identifiers
InChI
InChI=1S/C35H56O10/c1-30(2)9-11-35(17-36)12-10-32(4)18(19(35)13-30)7-8-23-31(3)14-21(38)27(42)34(6,26(31)20(37)15-33(23,32)5)29(43)45-28-25(41)24(40)22(39)16-44-28/h7,19-28,36-42H,8-17H2,1-6H3
0 references
InChIKey
YPBZWHXVEGSBDT-UHFFFAOYSA-N
0 references
PubChem CID
85433987
1 reference
based on heuristic
inferred from InChIKey
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