Cas no 59995-80-1 (24,25,26-Trinoroleanan-3-one,21-hydroxy-5,9,13-trimethyl-, (4b,5b,8a,9b,10a,13a,14b,21a)-)

24,25,26-Trinoroleanan-3-one,21-hydroxy-5,9,13-trimethyl-, (4b,5b,8a,9b,10a,13a,14b,21a)- structure
59995-80-1 structure
Product Name:24,25,26-Trinoroleanan-3-one,21-hydroxy-5,9,13-trimethyl-, (4b,5b,8a,9b,10a,13a,14b,21a)-
CAS No:59995-80-1
MF:C30H50O2
MW:442.716809749603
CID:368224
PubChem ID:3085172
Update Time:2025-04-19

24,25,26-Trinoroleanan-3-one,21-hydroxy-5,9,13-trimethyl-, (4b,5b,8a,9b,10a,13a,14b,21a)- Chemical and Physical Properties

Names and Identifiers

    • 24,25,26-Trinoroleanan-3-one,21-hydroxy-5,9,13-trimethyl-, (4b,5b,8a,9b,10a,13a,14b,21a)-
    • 21alpha-Hydroxyfriedelan-3-one
    • (4R,4aS,6aS,6aS,6bR,8aS,10R,12aR,14aS,14bS)-10-hydroxy-4,4a,6a,6b,8a,11,11,14a-octamethyl-2,4,5,6,6a,7,8,9,10,12,12a,13,14,14b-tetradecahydro-1H-picen-3-one
    • 21-hydroxyfriedelan-3-one
    • SCHEMBL3709004
    • 59995-80-1
    • 10-Hydroxy-4,4a,6b,8a,11,11,12b,14a-octamethylicosahydropicen-3(2H)-one
    • D:A-Friedooleanan-3-one, 21-hydroxy-, (21alpha)-
    • DTXSID70975413
    • Inchi： 1S/C30H50O2/c1-19-20(31)9-10-21-27(19,5)12-11-22-28(21,6)14-16-30(8)23-17-25(2,3)24(32)18-26(23,4)13-15-29(22,30)7/h19,21-24,32H,9-18H2,1-8H3/t19-,21+,22-,23+,24+,26-,27+,28-,29+,30-/m0/s1
    • InChI Key： VLNRAGRUEHHINT-ZXNIMFAASA-N
    • SMILES： O[C@H]1C(C)(C)C[C@@H]2[C@](C)(C1)CC[C@]1(C)[C@H]3CC[C@]4(C)[C@@H](C)C(CC[C@H]4[C@]3(C)CC[C@]12C)=O

Computed Properties

  • Exact Mass: 442.3813
  • Monoisotopic Mass: 442.381
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 2
  • Heavy Atom Count: 32
  • Rotatable Bond Count: 0
  • Complexity: 816
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 10
  • Undefined Atom Stereocenter Count : 0
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • XLogP3: 8.3
  • Topological Polar Surface Area: 37.3?2

Experimental Properties

  • Density: 1.006
  • Boiling Point: 510°C at 760 mmHg
  • Flash Point: 215.8°C
  • Refractive Index: 1.514
  • PSA: 37.3

24,25,26-Trinoroleanan-3-one,21-hydroxy-5,9,13-trimethyl-, (4b,5b,8a,9b,10a,13a,14b,21a)- Related Literature

Related Categories

59995-80-1 (24,25,26-Trinoroleanan-3-one,21-hydroxy-5,9,13-trimethyl-, (4b,5b,8a,9b,10a,13a,14b,21a)-) Related Products

Recommended suppliers
Hunan Well Medicine Synthesis Technology Co., Ltd.
Gold Member
Audited Supplier Audited Supplier
CN Supplier
Reagent
Hunan Well Medicine Synthesis Technology Co., Ltd.
Jiangsu Kolod Food Ingredients Co.,ltd
Gold Member
Audited Supplier Audited Supplier
CN Supplier
Bulk
Jiangsu Kolod Food Ingredients Co.,ltd
煙臺朗裕新材料科技有限公司
Gold Member
Audited Supplier Audited Supplier
CN Supplier
Reagent
Wuhan Comings Biotechnology Co., Ltd.
Gold Member
Audited Supplier Audited Supplier
CN Supplier
Bulk
Wuhan Comings Biotechnology Co., Ltd.
Hubei Cuiyuan Biotechnology Co.,Ltd
Gold Member
Audited Supplier Audited Supplier
CN Supplier
Reagent
Hubei Cuiyuan Biotechnology Co.,Ltd