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Substance Name: Azamulin [INN]
RN: 76530-44-4
UNII: 875AQ866X1
InChIKey: FMHQJXGMLMSMLC-WBUYAQKGSA-N

Note

  • A Cyp3A inhibitor.

Molecular Formula

  • C24-H38-N4-O4-S

Molecular Weight

  • 478.6542
 
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Names and Synonyms

Name of Substance

  • Azamulin [INN]

Synonyms

  • ((5-Amino-s-triazol-3-yl)thio)acetic acid, 8-ester with (3aS,4R,5S,6R,8R,9aR,10R)-6-ethyloctahydro-5,8-dihydroxy-4,6,9,10-tetramethyl-3a,9-propano-3aH-cyclopentacycloocten-1(4H)-one
  • ((5-Amino-s-triazol-3-yl)thio)acetic acid, 8-ester with (3aS,4R,5S,6R,8R,9R,9aR,10R)-6-ethyloctahydro-5,8-dihydroxy-4,6,9,10-tetramethyl-3a,9-propano-3aH-cyclopentacycloocten-1(4H)-one
  • (3aS,4R,5S,6R,8R,9R,9aR,10R)-6-Ethyldecahydro-5-hydroxy-4,6,9,10-tetramethyl-1-oxo-3a,9-propanocyclopentacycloocten-8-yl ((5-amino-1,2,4-triazol-3-yl)thio)acetat
  • Azamulin
  • Azamulinum
  • UNII-875AQ866X1

Registry Numbers

CAS Registry Number

  • 76530-44-4

FDA UNII

  • 875AQ866X1

System Generated Number

  • 0076530444

Structure Descriptors

InChI

1S/C24H38N4O4S/c1-6-22(4)11-16(32-17(30)12-33-21-26-20(25)27-28-21)23(5)13(2)7-9-24(14(3)19(22)31)10-8-15(29)18(23)24/h13-14,16,18-19,31H,6-12H2,1-5H3,(H3,25,26,27,28)/t13-,14+,16-,18+,19+,22-,23+,24+/m1/s1

InChIKey

FMHQJXGMLMSMLC-WBUYAQKGSA-N

Smiles

CC[C@]1(C)C[C@@H](OC(=O)CSc2nnc(N)[nH]2)[C@]3(C)[C@H](C)CC[C@]4(CCC(=O)[C@@H]34)[C@@H](C)[C@@H]1O