Pregnenolone acetate
CAS Registry Number®
1778-02-5
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CAS Name
Pregnenolone acetateMolecular Formula
C23H34O3Molecular Mass
358.51Cite this Page
Pregnenolone acetate. CAS Common Chemistry. CAS, a division of the American Chemical Society, n.d. http://commonchemistry.cas.org/ChemicalDetail.aspx?ref=1778-02-5 (retrieved ) (CAS RN: 1778-02-5). Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).Compound Properties
Melting Point (1)
148.5-149.5 °C
Source(s)
Other Names and Identifiers
InChI
InChI=1S/C23H34O3/c1-14(24)19-7-8-20-18-6-5-16-13-17(26-15(2)25)9-11-22(16,3)21(18)10-12-23(19,20)4/h5,17-21H,6-13H2,1-4H3/t17-,18-,19+,20-,21-,22-,23+/m0/s1
InChIKey
InChIKey=CRRKVZVYZQXICQ-RJJCNJEVSA-N
SMILES
C[C@@]12[C@]([C@]3([C@](CC1)([C@]4(C)C(=CC3)C[C@@H](OC(C)=O)CC4)[H])[H])(CC[C@@H]2C(C)=O)[H]
Canonical SMILES
O=C(OC1CC2=CCC3C(CCC4(C)C(C(=O)C)CCC34)C2(C)CC1)C
Other Names for this Substance
- Pregn-5-en-20-one, 3-(acetyloxy)-, (3β)-
- Pregn-5-en-20-one, 3β-hydroxy-, acetate
- (3β)-3-(Acetyloxy)pregn-5-en-20-one
- 3β-Acetoxy-Δ5-pregnen-20-one
- 3β-Acetoxy-5-pregnen-20-one
Deleted or Replaced CAS Registry Numbers
2414115-00-5
