17-Azido-3beta,16alpha-Dihydroxy-5alpha-Pregnane-11,20-Dione
[CAS# 5070-88-2]

Identification

• Name: 17-Azido-3beta,16alpha-Dihydroxy-5alpha-Pregnane-11,20-Dione
• Synonyms: (3S,5S,8S,9S,10S,13S,14S,16R,17S)-17-Azido-17-Ethanoyl-3,16-Dihydroxy-10,13-Dimethyl-2,3,4,5,6,7,8,9,12,14,15,16-Dodecahydro-1H-Cyclopenta[A]Phenanthren-11-One; 17-Azido-3Beta,16Alpha-Dihydroxy-5Alpha-Pregnane-11,20-Dione
• Molecular Formula: C₂₁H₃₁N₃O₄
• Molecular Weight: 389.49
• CAS Registry Number: 5070-88-2
• EINECS: 225-777-5
• SMILES: [C@]14([C@@]([C@@H](C[C@H]1[C@H]2[C@@H]([C@@]3([C@@H](CC2)C[C@H](CC3)O)C)C(C4)=O)O)(N=[N+]=[N-])C(=O)C)C
• InChI: 1S/C21H31N3O4/c1-11(25)21(23-24-22)17(28)9-15-14-5-4-12-8-13(26)6-7-19(12,2)18(14)16(27)10-20(15,21)3/h12-15,17-18,26,28H,4-10H2,1-3H3/t12-,13-,14-,15-,17+,18+,19-,20-,21+/m0/s1
• InChIKey: DIEUKTMUMCPTRI-KVHDYMSOSA-N