Cas no 32507-77-0 (17-(5,6-Dimethylhept-3-en-2-yl)-10,13-dimethyl-1,2,4,5,6,9,11,12,14,15,16,17-dodecahydrocyclopenta[a]phenanthren-3-one)

17-(5,6-Dimethylhept-3-en-2-yl)-10,13-dimethyl-1,2,4,5,6,9,11,12,14,15,16,17-dodecahydrocyclopenta[a]phenanthren-3-one structure
32507-77-0 structure
Product Name:17-(5,6-Dimethylhept-3-en-2-yl)-10,13-dimethyl-1,2,4,5,6,9,11,12,14,15,16,17-dodecahydrocyclopenta[a]phenanthren-3-one
CAS No:32507-77-0
MF:C28H44O
MW:396.648368835449
CID:308392
PubChem ID:99511
Update Time:2025-04-19

17-(5,6-Dimethylhept-3-en-2-yl)-10,13-dimethyl-1,2,4,5,6,9,11,12,14,15,16,17-dodecahydrocyclopenta[a]phenanthren-3-one Chemical and Physical Properties

Names and Identifiers

    • Ergosta-7,22-dien-3-one
    • 17-[(Z)-5,6-dimethylhept-3-en-2-yl]-10,13-dimethyl-1,2,4,5,6,9,11,12,14,15,16,17-dodecahydrocyclopenta[a]phenanthren-3-one
    • ergost-7,22-diene-3-ol
    • NSC 231803
    • [ "" ]
    • 17-(5,6-Dimethylhept-3-en-2-yl)-10,13-dimethyl-1,2,4,5,6,9,11,12,14,15,16,17-dodecahydrocyclopenta[a
    • 32507-77-0
    • CHEMBL5191846
    • 17-(5,6-dimethylhept-3-en-2-yl)-10,13-dimethyl-1,2,4,5,6,9,11,12,14,15,16,17-dodecahydrocyclopenta[a]phenanthren-3-one
    • (9R,10S,13R,14R,17R)-17-[(2R,5R)-5,6-dimethylhept-3-en-2-yl]-10,13-dimethyl-1,2,4,5,6,9,11,12,14,15,16,17-dodecahydrocyclopenta[a]phenanthren-3-one
    • CID 99511
    • (24S)24-Methylcholesta-7,22-dien-3-one
    • DA-63257
    • 17-(5,6-Dimethylhept-3-en-2-yl)-10,13-dimethyl-1,2,4,5,6,9,11,12,14,15,16,17-dodecahydrocyclopenta[a]phenanthren-3-one
    • Inchi: 1S/C28H44O/c1-18(2)19(3)7-8-20(4)24-11-12-25-23-10-9-21-17-22(29)13-15-27(21,5)26(23)14-16-28(24,25)6/h7-8,10,18-21,24-26H,9,11-17H2,1-6H3/t19-,20+,21?,24+,25-,26-,27-,28+/m0/s1
    • InChI Key: AHWOEMBXZXGDBQ-AQGSFBQWSA-N
    • SMILES: O=C1CC[C@@]2(C)C(C1)CC=C1[C@@H]2CC[C@]2(C)[C@@H]([C@@H](C=C[C@H](C)C(C)C)C)CC[C@H]21

Computed Properties

  • Exact Mass: 396.33900
  • Monoisotopic Mass: 396.339216023g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 1
  • Heavy Atom Count: 29
  • Rotatable Bond Count: 4
  • Complexity: 699
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 7
  • Undefined Atom Stereocenter Count : 1
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 1
  • Topological Polar Surface Area: 17.1
  • XLogP3: 7.3

Experimental Properties

  • Color/Form: Powder
  • Density: 0.99±0.1 g/cm3 (20 oC 760 Torr),
  • Melting Point: 183-184 oC
  • Boiling Point: 487.5±44.0 °C at 760 mmHg
  • Flash Point: 213.0±20.7 °C
  • Solubility: Insuluble (8.3E-6 g/L) (25 oC),
  • PSA: 17.07000
  • LogP: 7.61890
  • Vapor Pressure: 0.0±2.8 mmHg at 25°C

17-(5,6-Dimethylhept-3-en-2-yl)-10,13-dimethyl-1,2,4,5,6,9,11,12,14,15,16,17-dodecahydrocyclopenta[a]phenanthren-3-one Security Information

17-(5,6-Dimethylhept-3-en-2-yl)-10,13-dimethyl-1,2,4,5,6,9,11,12,14,15,16,17-dodecahydrocyclopenta[a]phenanthren-3-one Pricemore >>

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17-(5,6-Dimethylhept-3-en-2-yl)-10,13-dimethyl-1,2,4,5,6,9,11,12,14,15,16,17-dodecahydrocyclopenta[a]phenanthren-3-one Related Literature

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