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(Q105276426)
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English
9,11-Diacetyloxy-3-hydroxy-3a,5a,8,8,11a-pentamethyl-1-prop-1-en-2-yl-1,2,3,4,5,6,7,7a,9,10,11,11b,12,13,13a,13b-hexadecahydrocyclopenta[a]chrysene-5b-carboxylic acid
group of stereoisomers with the chemical formula C₃₄H₅₂O₇
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Statements
instance of
group of stereoisomers
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subclass of
lupane
1 reference
inferred from
lupane
mass
572.3713040039999
dalton
1 reference
based on heuristic
inferred from InChI
chemical formula
C₃₄H₅₂O₇
0 references
canonical SMILES
O=C(OC1CC(OC(=O)C)C2(C)C(CCC3(C(=O)O)C2CCC4C5C(C(=C)C)CC(O)C5(C)CCC43C)C1(C)C)C
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Identifiers
InChI
InChI=1S/C34H52O7/c1-18(2)21-16-25(37)31(7)14-15-32(8)22(28(21)31)10-11-24-33(9)23(12-13-34(24,32)29(38)39)30(5,6)26(40-19(3)35)17-27(33)41-20(4)36/h21-28,37H,1,10-17H2,2-9H3,(H,38,39)
0 references
InChIKey
UOKYXMPDWPELNG-UHFFFAOYSA-N
0 references
PubChem CID
73831039
2 references
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
UOKYXMPDWPELNG-UHFFFAOYSA-N
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