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Substance Name: Phomopsin
RN: 64925-80-0
InChIKey: FAFRRYBYQKPKSY-AJSRVUJESA-N

Classification Codes

  • Antimitotic Agents
  • Mitosis Modulators
  • Mutation Data
  • Reproductive Effect
  • Tubulin Modulators

Molecular Formula

  • C36-H45-Cl-N6-O12

Molecular Weight

  • 789.234
 
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Names and Synonyms

Name of Substance

  • Phomopsin

Synonym

  • Phomopsin A

Systematic Name

  • Phomopsin A

Registry Numbers

CAS Registry Number

  • 64925-80-0

System Generated Number

  • 0064925800

Structure Descriptors

InChI

1S/C36H45ClN6O12/c1-8-17(5)25(32(50)39-20(35(53)54)15-23(44)45)41-30(48)21-11-10-12-43(21)34(52)29-36(6,9-2)55-22-14-18(13-19(37)28(22)47)27(46)26(38-7)33(51)40-24(16(3)4)31(49)42-29/h10-11,13-15,21,24,26-27,29,38,46-47H,3,8-9,12H2,1-2,4-7H3,(H,39,50)(H,40,51)(H,41,48)(H,42,49)(H,44,45)(H,53,54)/b20-15+,25-17+/t21-,24-,26-,27-,29+,36+/m0/s1

InChIKey

FAFRRYBYQKPKSY-AJSRVUJESA-N

Smiles

C(=O)(N1CC=C[C@H]1C(N\C(=C(/C)CC)C(N\C(C(=O)O)=C\C(=O)O)=O)=O)[C@@H]1[C@@](Oc2c(c(cc(c2)[C@H](O)[C@@H](C(N[C@@H](C(=C)C)C(N1)=O)=O)NC)Cl)O)(C)CC

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
domestic animals - goat/sheep LD50 subcutaneous 10ug/kg (0.01mg/kg)   Australian Veterinary Journal. Vol. 64, Pg. 293, 1987.
domestic animals - goat/sheep LDLo parenteral 1mg/kg (1mg/kg)   Australian Veterinary Journal. Vol. 64, Pg. 293, 1987.
rat LD50 unreported 5mg/kg (5mg/kg)   Australian Journal of Experimental Biology and Medical Science. Vol. 61, Pg. 105, 1983.