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(Q104201616)
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English
6-(1,3-Dihydroxy-2,3-dimethylbutyl)-2,16-dihydroxy-7,9,13-trimethyl-5-oxapentacyclo[10.8.0.02,9.04,8.013,18]icos-1(20)-en-19-one
group of stereoisomers with the chemical formula C₂₈H₄₄O₆
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Statements
instance of
group of stereoisomers
0 references
subclass of
ergostane steroid
1 reference
inferred from
ergostane steroid
mass
476.3137891279998
dalton
1 reference
based on heuristic
inferred from InChI
chemical formula
C₂₈H₄₄O₆
0 references
canonical SMILES
O=C1C=C2C(CCC3(C)C4C(OC(C(O)C(C)C(O)(C)C)C4C)CC23O)C5(C)CCC(O)CC15
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Identifiers
InChI
InChI=1S/C28H44O6/c1-14-22-21(34-24(14)23(31)15(2)25(3,4)32)13-28(33)18-12-20(30)19-11-16(29)7-9-26(19,5)17(18)8-10-27(22,28)6/h12,14-17,19,21-24,29,31-33H,7-11,13H2,1-6H3
0 references
InChIKey
YEMLNZKGKQAXTR-UHFFFAOYSA-N
0 references
PubChem CID
74065782
2 references
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
YEMLNZKGKQAXTR-UHFFFAOYSA-N
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