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Substance Name: Chromomycin A4
RN: 7198-11-0
InChIKey: GFNBGDMLFDVPCB-UHFFFAOYSA-N

Classification Codes

  • Drug / Therapeutic Agent
  • Natural Product

Molecular Formula

  • C48-H68-O22

Molecular Weight

  • 997.043
 
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Names and Synonyms

  • Chromomycin A4

Registry Numbers

CAS Registry Number

  • 7198-11-0

System Generated Number

  • 0007198110

Structure Descriptors

InChI

1S/C48H68O22/c1-17-29(67-34-16-31(46(22(6)65-34)66-23(7)50)69-33-14-28(52)45(60-8)21(5)64-33)12-25-10-24-11-26(47(61-9)44(59)39(54)18(2)49)48(43(58)37(24)42(57)36(25)38(17)53)70-35-15-30(41(56)20(4)63-35)68-32-13-27(51)40(55)19(3)62-32/h10,12,18-22,26-28,30-35,39-41,45-49,51-57H,11,13-16H2,1-9H3

InChIKey

GFNBGDMLFDVPCB-UHFFFAOYSA-N

Smiles

O1[C@@H](C)[C@@H]([C@@H](C[C@@H]1O[C@@H]1C(=O)c2c(c3c(cc2C[C@@H]1[C@@H](C([C@@H]([C@@H](C)O)O)=O)OC)cc(c(c3O)C)O[C@@H]1O[C@@H]([C@@H]([C@@H](C1)O[C@@H]1C[C@@H]([C@@H]([C@@H](O1)C)OC)O)OC(C)=O)C)O)O[C@@H]1C[C@@H](O)[C@@H]([C@@H](C)O1)O)O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intravenous 1500ug/kg (1.5mg/kg)   "CRC Handbook of Antibiotic Compounds," Vols.1- , Berdy, J., Boca Raton, FL, CRC Press, 1980Vol. 1, Pg. 331, 1980.