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Substance Name: Veracevine
RN: 5876-23-3
UNII: U3QTV3Z77R
InChIKey: MZHXYVMEVBEFAL-XXFAKQOHSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C27-H43-N-O8

Molecular Weight

  • 509.6357
 
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Names and Synonyms

Name of Substance

  • Veracevine

Synonyms

  • 4,9-Epoxycevane-3-beta,4-beta,12,14,16-beta,17,20-heptol
  • NSC 127570
  • Protocevin
  • Protocevine
  • UNII-U3QTV3Z77R
  • Veracevin
  • Veracevine

Systematic Names

  • Cevane-3-beta,4-beta,12,14,16-beta,17,20-heptol, 4,9-epoxy-
  • Cevane-3beta,4beta,12,14,16beta,17,20-heptol, 4,9-epoxy- (8CI)

Registry Numbers

CAS Registry Number

  • 5876-23-3

FDA UNII

  • U3QTV3Z77R

System Generated Number

  • 0005876233

Structure Descriptors

InChI

1S/C27H43NO8/c1-14-4-7-18-22(3,31)26(34)17(12-28(18)11-14)24(33)13-25-16(23(24,32)10-20(26)30)6-5-15-21(25,2)9-8-19(29)27(15,35)36-25/h14-20,29-35H,4-13H2,1-3H3/t14-,15-,16-,17-,18-,19-,20-,21-,22+,23+,24+,25+,26-,27-/m0/s1

InChIKey

MZHXYVMEVBEFAL-XXFAKQOHSA-N

Smiles

C[C@H]1CC[C@@H]2N(C1)C[C@H]3[C@]4(O)C[C@]56O[C@]7(O)[C@@H](O)CC[C@@]5(C)[C@@H]7CC[C@H]6[C@]4(O)C[C@H](O)[C@]3(O)[C@]2(C)O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal > 100mg/kg (100mg/kg)   Journal of Agricultural and Food Chemistry. Vol. 39, Pg. 1875, 1991.
mouse LD50 intravenous 54mg/kg (54mg/kg)   Collection of Czechoslovak Chemical Communications. Vol. 21, Pg. 743, 1956.
mouse LD50 subcutaneous > 200mg/kg (200mg/kg)   Journal of Pharmacology and Experimental Therapeutics. Vol. 113, Pg. 89, 1955.