7-Ketositosterol
CAS Registry Number®
2034-74-4
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CAS Name
7-KetositosterolMolecular Formula
C29H48O2Molecular Mass
428.69Cite this Page
7-Ketositosterol. CAS Common Chemistry. CAS, a division of the American Chemical Society, n.d. http://commonchemistry.cas.org/ChemicalDetail.aspx?ref=2034-74-4 (retrieved ) (CAS RN: 2034-74-4). Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).Compound Properties
Melting Point (1)
120-123 °C
Source(s)
Other Names and Identifiers
InChI
InChI=1S/C29H48O2/c1-7-20(18(2)3)9-8-19(4)23-10-11-24-27-25(13-15-29(23,24)6)28(5)14-12-22(30)16-21(28)17-26(27)31/h17-20,22-25,27,30H,7-16H2,1-6H3/t19-,20-,22+,23-,24+,25+,27+,28+,29-/m1/s1
InChIKey
InChIKey=ICFXJOAKQGDRCT-ZIHMWMKCSA-N
SMILES
C[C@@]12[C@]([C@]3([C@@]([C@]4(C)C(=CC3=O)C[C@@H](O)CC4)(CC1)[H])[H])(CC[C@@]2([C@@H](CC[C@H](C(C)C)CC)C)[H])[H]
Canonical SMILES
O=C1C=C2CC(O)CCC2(C)C3CCC4(C)C(CCC4C13)C(C)CCC(CC)C(C)C
Other Names for this Substance
- Stigmast-5-en-7-one, 3-hydroxy-, (3β)-
- Stigmast-5-en-7-one, 3β-hydroxy-
- (3β)-3-Hydroxystigmast-5-en-7-one
- Stigmast-5-en-3β-ol-7-one
- 7-Oxo-β-sitosterol
Deleted or Replaced CAS Registry Numbers
4795-35-1, 191410-79-4
