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(Q82894110)
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English
5,6-Epoxycholestan-3-ol
chemical compound
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Statements
instance of
group of stereoisomers
0 references
subclass of
chemical compound
0 references
mass
402.349780712
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₂₇H₄₆O₂
1 reference
based on heuristic
inferred from SMILES
canonical SMILES
CC(C)CCCC(C)C1CCC2C3CC4OC45CC(O)CCC5(C)C3CCC12C
1 reference
based on heuristic
inferred from isomeric SMILES
isomeric SMILES
CC(C)CCC[C@@H](C)[C@H]1CC[C@H]2[C@@H]3C[C@@H]4OC45C[C@@H](O)CC[C@]5(C)[C@H]3CC[C@]12C
1 reference
based on heuristic
inferred from InChI
Identifiers
InChI
InChI=1S/C27H46O2/c1-17(2)7-6-8-18(3)21-9-10-22-20-15-24-27(29-24)16-19(28)11-14-26(27,5)23(20)12-13-25(21,22)4/h17-24,28H,6-16H2,1-5H3/t18-,19+,20+,21-,22+,23+,24+,25-,26-,27?/m1/s1
0 references
InChIKey
PRYIJAGAEJZDBO-MQXRBXAXSA-N
0 references
CAS Registry Number
114246-94-5
0 references
PubChem CID
188855
1 reference
stated in
PubChem
retrieved
26 December 2021
inferred from
InChIKey
UniChem compound ID
44651307
1 reference
stated in
UniChem
DSSTox substance ID
DTXSID80921305
0 references
DSSTOX compound identifier
DTXCID001350204
0 references
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