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Substance Name: Actinomycin F1
RN: 1402-44-4
UNII: D8HJS52NSZ
InChIKey: CQWJGMPBDQNEKC-UKCZNJPKSA-N

Classification Codes

  • Drug / Therapeutic Agent
  • Natural Product

Molecular Formula

  • C58-H88-N12-O16

Molecular Weight

  • 1217.3806
 
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Names and Synonyms

Name of Substance

  • Actinomycin F1

Synonyms

  • Actinomycin KS4
  • KS4
  • UNII-D8HJS52NSZ

Systematic Name

  • Actinomycin F1

Registry Numbers

CAS Registry Number

  • 1402-44-4

FDA UNII

  • D8HJS52NSZ

System Generated Number

  • 0001402444

Structure Descriptors

InChI

1S/C59H84N12O16/c1-19-29(8)42-57(82)69(16)23-36(73)67(14)25-38(75)70(17)47(27(4)5)58(83)85-32(11)43(55(80)63-42)64-52(77)34-21-20-30(9)50-45(34)61-46-39(40(60)49(76)31(10)51(46)87-50)53(78)65-44-33(12)86-59(84)48(28(6)7)71(18)37(74)24-66(13)35(72)22-68(15)56(81)41(26(2)3)62-54(44)79/h20-21,26-29,32-33,41-44,47-48H,19,22-25,60H2,1-18H3,(H,62,79)(H,63,80)(H,64,77)(H,65,78)/t29-,32+,33+,41+,42+,43-,44-,47-,48-/m0/s1

InChIKey

CQWJGMPBDQNEKC-UKCZNJPKSA-N

Smiles

CC[C@H](C)[C@@H]1C(=O)N(CC(=O)N(CC(=O)N([C@H](C(=O)O[C@@H]([C@@H](C(=O)N1)NC(=O)c2ccc(c3c2nc-4c(c(c(=O)c(c4o3)C)N)C(=O)N[C@H]5[C@H](OC(=O)[C@@H](N(C(=O)CN(C(=O)CN(C(=O)[C@H](NC5=O)C(C)C)C)C)C)C(C)C)C)C)C)C(C)C)C)C)C

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 1mg/kg (1mg/kg)   "CRC Handbook of Antibiotic Compounds," Vols.1- , Berdy, J., Boca Raton, FL, CRC Press, 1980Vol. 4(2), Pg. 66, 1980.
mouse LD50 intravenous 8mg/kg (8mg/kg)   "Structure-Activity Relationship among the Semisynthetic Antibiotics," Perlman, D., ed., New York, Academic Press, 1977Vol. -, Pg. 427, 1977.