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Substance Name: Cytochalasin j
RN: 56144-22-0
InChIKey: UKQNIEMKORIOQM-GRIAELCMSA-N

Classification Codes

  • Drug / Therapeutic Agent
  • Natural Product

Molecular Formula

  • C28-H37-N-O4

Molecular Weight

  • 451.603
 
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Names and Synonyms

Name of Substance

  • Cytochalasin J

Synonyms

  • 7,18,21-Trihydroxy-16,18-dimethyl-10-phenyl-(11)cytochalasa-6(12),13,19-trien-1-one
  • Cytochalasin J
  • Kodocytochalasin 2
  • Paspalin P
  • Paspalin P II

Systematic Name

  • (11)Cytochalasa-6(12),13,19-trien-1-one, 7,18,21-trihydroxy-16,18-dimethyl-10-phenyl-

Registry Numbers

CAS Registry Number

  • 56144-22-0

System Generated Number

  • 0056144220

Structure Descriptors

InChI

1S/C28H37NO4/c1-17-9-8-12-21-25(31)19(3)18(2)24-22(15-20-10-6-5-7-11-20)29-26(32)28(21,24)23(30)13-14-27(4,33)16-17/h5-8,10-14,17-18,21-25,30-31,33H,3,9,15-16H2,1-2,4H3,(H,29,32)/b12-8+,14-13+/t17?,18-,21+,22+,23-,24+,25?,27?,28?/m1/s1

InChIKey

UKQNIEMKORIOQM-GRIAELCMSA-N

Smiles

C1([C@@]23[C@H]([C@@H](Cc4ccccc4)N1)[C@@H](C(=C)[C@@H]([C@@H]2C=CC[C@@H](C)C[C@@](C=C[C@H]3O)(C)O)O)C)=O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intravenous 5mg/kg (5mg/kg)   "CRC Handbook of Antibiotic Compounds," Vols.1- , Berdy, J., Boca Raton, FL, CRC Press, 1980Vol. 2, Pg. 440, 1980.