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(Q104921873)
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English
4a,4b,7,7,10a-pentamethyl-2-(3-methyl-4-oxopentyl)-8-(3,4,5-trihydroxyoxan-2-yl)oxy-4,5,6,6a,8,9,10,10b-octahydro-3H-chrysene-2-carboxylic acid
group of stereoisomers with the chemical formula C₃₅H₅₄O₈
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Statements
instance of
group of stereoisomers
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subclass of
chemical compound
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mass
602.3818686879999
dalton
1 reference
based on heuristic
inferred from InChI
chemical formula
C₃₅H₅₄O₈
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canonical SMILES
O=C(O)C1(C=C2C=CC3C4(C)CCC(OC5OCC(O)C(O)C5O)C(C)(C)C4CCC3(C)C2(C)CC1)CCC(C(=O)C)C
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Identifiers
InChI
InChI=1S/C35H54O8/c1-20(21(2)36)10-15-35(30(40)41)17-16-33(6)22(18-35)8-9-25-32(5)13-12-26(31(3,4)24(32)11-14-34(25,33)7)43-29-28(39)27(38)23(37)19-42-29/h8-9,18,20,23-29,37-39H,10-17,19H2,1-7H3,(H,40,41)
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InChIKey
AZQKTLRPVJYYOV-UHFFFAOYSA-N
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PubChem CID
85445606
1 reference
based on heuristic
inferred from InChIKey
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