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Substance Name: Bottromycin A hydrazide
RN: 11028-12-9
InChIKey: MXJRDMDTCKCBSY-HKENLTQOSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C41-H62-N10-O6-S

Molecular Weight

  • 823.0708
 
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Names and Synonyms

Synonym

  • Bottromycic A acid, hydrazide

Systematic Name

  • Bottromycin A hydrazide

Registry Numbers

CAS Registry Number

  • 11028-12-9

System Generated Number

  • 0011028129

Structure Descriptors

InChI

1S/C41H62N10O6S/c1-22(2)29-35(54)49-32(40(5,6)7)34(44-21-28(53)51-18-16-23(3)31(51)37(56)46-29)48-33(41(8,9)10)38(57)47-30(24(4)25-14-12-11-13-15-25)36(55)45-26(20-27(52)50-42)39-43-17-19-58-39/h11-15,17,19,22-24,26,29-33H,16,18,20-21,42H2,1-10H3,(H,44,48)(H,45,55)(H,46,56)(H,47,57)(H,49,54)(H,50,52)/t23-,24+,26+,29+,30-,31+,32-,33-/m1/s1

InChIKey

MXJRDMDTCKCBSY-HKENLTQOSA-N

Smiles

C[C@@H]1CCN2[C@@H]1C(=O)N[C@H](C(=O)N[C@H](/C(=N/[C@H](C(=O)N[C@H]([C@@H](C)c3ccccc3)C(=O)N[C@@H](CC(=O)NN)c4nccs4)C(C)(C)C)/NCC2=O)C(C)(C)C)C(C)C

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 350mg/kg (350mg/kg)   Journal of Antibiotics, Series A. Vol. 19, Pg. 149, 1966.
mouse LD50 subcutaneous 700mg/kg (700mg/kg)   Journal of Antibiotics, Series A. Vol. 19, Pg. 149, 1966.