Cas no 37413-99-3 (9β,11β-Epoxy-21dehydroxy Betamethasone)

9β,11β-Epoxy-21dehydroxy Betamethasone structure
37413-99-3 structure
Product Name:9β,11β-Epoxy-21dehydroxy Betamethasone
CAS No:37413-99-3
MF:C22H28O4
MW:356.455327033997
CID:296775
PubChem ID:11646120
Update Time:2025-04-19

9β,11β-Epoxy-21dehydroxy Betamethasone Chemical and Physical Properties

Names and Identifiers

    • Pregna-1,4-diene-3,20-dione,9,11-epoxy-17-hydroxy-16-methyl-, (9b,11b,16b)-
    • 9,11b-Epoxy-17-hydroxy-16b-methyl-9b-pregna-1,4-diene-3,20-dione
    • 9β,11β-Epoxy-21dehydroxy Betamethasone
    • 16β-methyl-9β,11β-epoxy-17α-hydroxy-1,4-pregnadiene-3,20-dione
    • 9,11-Epoxy-16-methylpregna-1,4-dien-17-ol-3,20-dione
    • (9beta)-9,11beta-Epoxy-16beta-methyl-17-hydroxypregna-1,4-diene-3,20-dione
    • (4aS,4bS,5aS,6aS,7R,8S,9aS,9bS)-7-Acetyl-7-hydroxy-4a,6a,8-trimethyl-5a,6,6a,7,8,9,9a,9b,10,11-decahydrocyclopenta[1,2]phenanthro[4,4a-b]oxiren-2(4aH)-one
    • SCHEMBL10497112
    • 37413-99-3
    • (1S,2S,10S,11S,13S,14R,15S,17S)-14-acetyl-14-hydroxy-2,13,15-trimethyl-18-oxapentacyclo[8.8.0.01,17.02,7.011,15]octadeca-3,6-dien-5-one
    • Inchi: 1S/C22H28O4/c1-12-9-17-16-6-5-14-10-15(24)7-8-19(14,3)22(16)18(26-22)11-20(17,4)21(12,25)13(2)23/h7-8,10,12,16-18,25H,5-6,9,11H2,1-4H3/t12-,16-,17-,18-,19-,20-,21-,22+/m0/s1
    • InChI Key: JGIRPEXTUMTWKF-NDBOTOLBSA-N
    • SMILES: O1[C@H]2C[C@]3(C)[C@@](C(C)=O)([C@@H](C)C[C@H]3[C@@H]3CCC4=CC(C=C[C@]4(C)[C@@]132)=O)O

Computed Properties

  • Exact Mass: 356.19875937g/mol
  • Monoisotopic Mass: 356.19875937g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 4
  • Heavy Atom Count: 26
  • Rotatable Bond Count: 1
  • Complexity: 796
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 8
  • Undefined Atom Stereocenter Count : 0
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • XLogP3: 2.1
  • Topological Polar Surface Area: 66.9?2

Experimental Properties

  • PSA: 66.90000
  • LogP: 2.99170

9β,11β-Epoxy-21dehydroxy Betamethasone Pricemore >>

Related Categories No. Product Name Cas No. Purity Specification Price update time Inquiry
TRC
E589140-50mg
9β,11β-Epoxy-21dehydroxy Betamethasone
37413-99-3
50mg
$207.00 2023-05-18
TRC
E589140-500mg
9β,11β-Epoxy-21dehydroxy Betamethasone
37413-99-3
500mg
$1642.00 2023-05-18
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