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(Q82882415)
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English
15-Methylcholest-7-ene-3,15-diol
group of stereoisomers with the chemical formula C₂₈H₄₈O₂
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Statements
instance of
group of stereoisomers
0 references
subclass of
chemical compound
0 references
mass
416.365430776
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₂₈H₄₈O₂
1 reference
based on heuristic
inferred from SMILES
canonical SMILES
CC(C)CCCC(C)C1CC(C)(O)C2C3=CCC4CC(O)CCC4(C)C3CCC12C
1 reference
based on heuristic
inferred from isomeric SMILES
isomeric SMILES
CC(C)CCC[C@@H](C)[C@H]1CC(C)(O)[C@@H]2C3=CC[C@H]4C[C@@H](O)CC[C@]4(C)[C@H]3CC[C@]12C
1 reference
based on heuristic
inferred from InChI
Identifiers
InChI
InChI=1S/C28H48O2/c1-18(2)8-7-9-19(3)24-17-28(6,30)25-22-11-10-20-16-21(29)12-14-26(20,4)23(22)13-15-27(24,25)5/h11,18-21,23-25,29-30H,7-10,12-17H2,1-6H3/t19-,20+,21+,23+,24-,25-,26+,27-,28?/m1/s1
0 references
InChIKey
YEKYBNIATRJFGM-HOFOHDGYSA-N
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CAS Registry Number
111394-04-8
0 references
PubChem CID
196653
1 reference
stated in
PubChem
retrieved
26 December 2021
inferred from
InChIKey
UniChem compound ID
63631537
1 reference
stated in
UniChem
DSSTox substance ID
DTXSID10912140
0 references
DSSTOX compound identifier
DTXCID001341168
0 references
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