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Substance Name: Cirramycin A1, 12,13-deepoxy-12,13-didehydro-20-deoxo-4'-deoxy-20-hydroxy-
RN: 58947-83-4
InChIKey: KOARRXOZPWLCJM-MUUZYNTISA-N

Classification Codes

  • Drug / Therapeutic Agent
  • Natural Product

Molecular Formula

  • C31-H53-N-O8

Molecular Weight

  • 567.7587
 
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Names and Synonyms

Synonyms

  • 12,13-Deepoxy-12,13-didehydro-20-deoxo-4'-deoxy-20-hydroxycirramycin A1
  • Antibiotic M 4365G3
  • Juvenimicin B1

Systematic Name

  • Cirramycin A1, 12,13-deepoxy-12,13-didehydro-20-deoxo-4'-deoxy-20-hydroxy-

Registry Numbers

CAS Registry Number

  • 58947-83-4

Other Registry Number

  • 65207-63-8

System Generated Number

  • 0058947834

Structure Descriptors

InChI

1S/C31H53NO8/c1-9-27-20(4)14-18(2)10-11-25(34)19(3)15-23(12-13-33)30(22(6)26(35)17-28(36)39-27)40-31-29(37)24(32(7)8)16-21(5)38-31/h10-11,14,19-24,26-27,29-31,33,35,37H,9,12-13,15-17H2,1-8H3/b11-10+,18-14-

InChIKey

KOARRXOZPWLCJM-MUUZYNTISA-N

Smiles

CCC1C(/C=C(/C=C/C(=O)C(CC(C(C(C(CC(=O)O1)O)C)OC2C(C(CC(O2)C)N(C)C)O)CCO)C)\C)C

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 125mg/kg (125mg/kg)   Journal of Antibiotics. Vol. 29, Pg. 1171, 1976.