Cas no 19459-68-8 ([(3s,5s,8r,9s,10s,13s,14s,16s,17s)-17-acetyl-10,13-dimethyl-12-oxo-16-(2-oxocyclopentyl)-1,2,3,4,5,6,7,8,9,11,14,15,16,17-tetradecahydrocyclopenta[a]phenanthren-3-yl] Acetate)

[(3s,5s,8r,9s,10s,13s,14s,16s,17s)-17-acetyl-10,13-dimethyl-12-oxo-16-(2-oxocyclopentyl)-1,2,3,4,5,6,7,8,9,11,14,15,16,17-tetradecahydrocyclopenta[a]phenanthren-3-yl] Acetate structure
19459-68-8 structure
Product Name:[(3s,5s,8r,9s,10s,13s,14s,16s,17s)-17-acetyl-10,13-dimethyl-12-oxo-16-(2-oxocyclopentyl)-1,2,3,4,5,6,7,8,9,11,14,15,16,17-tetradecahydrocyclopenta[a]phenanthren-3-yl] Acetate
CAS No:19459-68-8
MF:C28H40O5
MW:456.61420917511
CID:1387064
PubChem ID:250201
Update Time:2025-04-20

[(3s,5s,8r,9s,10s,13s,14s,16s,17s)-17-acetyl-10,13-dimethyl-12-oxo-16-(2-oxocyclopentyl)-1,2,3,4,5,6,7,8,9,11,14,15,16,17-tetradecahydrocyclopenta[a]phenanthren-3-yl] Acetate Chemical and Physical Properties

Names and Identifiers

    • [(3s,5s,8r,9s,10s,13s,14s,16s,17s)-17-acetyl-10,13-dimethyl-12-oxo-16-(2-oxocyclopentyl)-1,2,3,4,5,6,7,8,9,11,14,15,16,17-tetradecahydrocyclopenta[a]phenanthren-3-yl] Acetate
    • MLS002693645
    • AC1L5H66
    • CTK4E1564
    • NSC69291
    • AG-K-46821
    • AR-1A8343
    • KST-1A2824
    • MLS002693645; AC1L5H66; CTK4E1564; NSC69291; AG-K-46821; AR-1A8343; KST-1A2824;
    • DTXSID80290543
    • 19459-68-8
    • NSC-69291
    • Inchi： 1S/C28H40O5/c1-15(29)26-21(19-6-5-7-24(19)31)13-23-20-9-8-17-12-18(33-16(2)30)10-11-27(17,3)22(20)14-25(32)28(23,26)4/h17-23,26H,5-14H2,1-4H3/t17-,18-,19?,20+,21-,22-,23-,26-,27-,28+/m0/s1
    • InChI Key： BEJRUZSNNGTWRU-YCLAGUJOSA-N
    • SMILES： O=C1C[C@@H]2[C@@]3(C)CC[C@@H](C[C@@H]3CC[C@H]2[C@@H]2C[C@@H](C3C(CCC3)=O)[C@H](C(C)=O)[C@]21C)OC(C)=O

Computed Properties

  • Exact Mass: 456.2877
  • Monoisotopic Mass: 456.288
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 5
  • Heavy Atom Count: 33
  • Rotatable Bond Count: 4
  • Complexity: 878
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 9
  • Undefined Atom Stereocenter Count : 1
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • XLogP3: 3.9
  • Topological Polar Surface Area: 77.5?2

Experimental Properties

  • Density: 1.16
  • Boiling Point: 571.6°C at 760 mmHg
  • Flash Point: 242.4°C
  • Refractive Index: 1.542
  • PSA: 77.51
  • LogP: 4.94030

[(3s,5s,8r,9s,10s,13s,14s,16s,17s)-17-acetyl-10,13-dimethyl-12-oxo-16-(2-oxocyclopentyl)-1,2,3,4,5,6,7,8,9,11,14,15,16,17-tetradecahydrocyclopenta[a]phenanthren-3-yl] Acetate Suppliers

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(CAS:19459-68-8)5α-Pregnane-12,20-dione, 3β-hydroxy-16α-(2-oxocyclopentyl)-, acetate (8CI)
Order Number:NC19961
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Quantity:10g
Purity:97%
Pricing Information Last Updated:Friday, 18 July 2025 16:10
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[(3s,5s,8r,9s,10s,13s,14s,16s,17s)-17-acetyl-10,13-dimethyl-12-oxo-16-(2-oxocyclopentyl)-1,2,3,4,5,6,7,8,9,11,14,15,16,17-tetradecahydrocyclopenta[a]phenanthren-3-yl] Acetate Related Literature

19459-68-8 ([(3s,5s,8r,9s,10s,13s,14s,16s,17s)-17-acetyl-10,13-dimethyl-12-oxo-16-(2-oxocyclopentyl)-1,2,3,4,5,6,7,8,9,11,14,15,16,17-tetradecahydrocyclopenta[a]phenanthren-3-yl] Acetate) Related Products

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NewCan Biotech Limited
(CAS:19459-68-8)5α-Pregnane-12,20-dione, 3β-hydroxy-16α-(2-oxocyclopentyl)-, acetate (8CI)
NC19961
Purity:97%
Quantity:10g
Price ($):Inquiry
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