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Substance Name: Vincaleukoblastine, 6,7-dihydro-
RN: 13309-27-8
InChIKey: CWRJYPJHZKVJAX-UHFFFAOYSA-N

Molecular Formula

  • C46-H60-N4-O9

Molecular Weight

  • 812.999
 
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Names and Synonyms

Synonyms

  • 6,7-Dihydrovincaleukoblastine
  • BRN 0605147
  • Dihydrovinblastine
  • Dihydrovincaleukoblastine

Systematic Name

  • Vincaleukoblastine, 6,7-dihydro-

Registry Numbers

CAS Registry Number

  • 13309-27-8

System Generated Number

  • 0013309278

Structure Descriptors

InChI

1S/C46H60N4O9/c1-8-42(54)23-28-24-45(40(52)57-6,36-30(15-19-49(25-28)26-42)29-13-10-11-14-33(29)47-36)32-21-31-34(22-35(32)56-5)48(4)38-44(31)17-20-50-18-12-16-43(9-2,37(44)50)39(59-27(3)51)46(38,55)41(53)58-7/h10-11,13-14,21-22,28,37-39,47,54-55H,8-9,12,15-20,23-26H2,1-7H3

InChIKey

CWRJYPJHZKVJAX-UHFFFAOYSA-N

Smiles

C(OC)(=O)[C@@]1([C@@H]2N(c3c([C@@]42[C@@H]2[C@@](CCC[N@@]2CC4)([C@@H]1OC(C)=O)CC)cc(c(c3)OC)[C@@]1(c2[nH]c3c(c2CC[N@@]2C[C@@H](C1)C[C@@](O)(CC)C2)cccc3)C(=O)OC)C)O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 142mg/kg (142mg/kg)   Biochemical Pharmacology. Vol. 26, Pg. 1213, 1977.