| Identification | Back Directory | [Name]
EPICHOLESTEROL | [CAS]
474-77-1 | [Synonyms]
EpichoL
EPICHOLESTEROL
3α-Cholesterol
5-CHOLESTEN-3-ALPHA-OL
cholest-5-en-3-alpha-ol
Cholest-5-en-3-ol,(3α)-
Cholest-5-en-3-ol, (3a)-
(3R,8S,9S,10R,13R,14S,17R)-10,13-dimethyl-17-[(2R)-6-methylheptan-2-yl]-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-ol | [Molecular Formula]
C27H46O | [MDL Number]
MFCD00201278 | [MOL File]
474-77-1.mol | [Molecular Weight]
386.65 |
| Chemical Properties | Back Directory | [Melting point ]
141.5° | [alpha ]
D30 -35° (c = 1 in alcohol) | [Boiling point ]
452.8°C (rough estimate) | [density ]
0.9610 (rough estimate) | [refractive index ]
1.5100 (estimate) | [pka]
15.03±0.70(Predicted) | [InChIKey]
HVYWMOMLDIMFJA-DLFILBLINA-N | [SMILES]
[C@@]12([H])CC[C@H]([C@H](C)CCCC(C)C)[C@@]1(C)CC[C@]1([H])[C@@]3(C)CC[C@@H](O)CC3=CC[C@@]21[H] |&1:0,4,5,13,17,19,23,29,r| |
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