Stigmast-4-en-3-one

CAS Registry Number®

1058-61-3
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CAS Name

Stigmast-4-en-3-one

Molecular Formula

C29H48O

Molecular Mass

412.69

Cite this Page

Stigmast-4-en-3-one.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/ChemicalDetail.aspx?ref=1058-61-3 (retrieved 2024-04-29) (CAS RN: 1058-61-3).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    82 °C

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C29H48O/c1-7-21(19(2)3)9-8-20(4)25-12-13-26-24-11-10-22-18-23(30)14-16-28(22,5)27(24)15-17-29(25,26)6/h18-21,24-27H,7-17H2,1-6H3/t20-,21-,24+,25-,26+,27+,28+,29-/m1/s1

InChIKey

InChIKey=RUVUHIUYGJBLGI-XJZKHKOHSA-N

SMILES

C[C@@]12[C@]([C@]3([C@@]([C@]4(C)C(CC3)=CC(=O)CC4)(CC1)[H])[H])(CC[C@@]2([C@@H](CC[C@H](C(C)C)CC)C)[H])[H]

Canonical SMILES

O=C1C=C2CCC3C(CCC4(C)C(CCC34)C(C)CCC(CC)C(C)C)C2(C)CC1

Other Names for this Substance

  • Stigmast-4-en-3-one
  • β-Sitost-4-en-3-one
  • Sitostenone
  • (24R)-24-Ethylcholest-4-en-3-one
  • Δ4-Sitosterol-3-one

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