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Substance Name: Actinomycin F2
RN: 1402-45-5
InChIKey: VGAPFJVVEOUDPN-YRKRLMRRSA-N

Classification Codes

  • Drug / Therapeutic Agent
  • Natural Product

Molecular Formula

  • C60-H90-N12-O16

Molecular Weight

  • 1243.4184
 
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Names and Synonyms

  • Actinomycin F2

Registry Numbers

CAS Registry Number

  • 1402-45-5

System Generated Number

  • 0001402455

Structure Descriptors

InChI

1S/C61H86N12O16/c1-18-30(8)43-58(83)70(15)24-37(74)68(13)25-38(75)71(16)48(28(4)5)60(85)87-33(11)44(56(81)65-43)66-53(78)35-22-21-31(9)51-46(35)63-47-40(41(62)50(77)32(10)52(47)89-51)54(79)67-45-34(12)88-61(86)49(29(6)7)72(17)39(76)26-69(14)57(82)36-20-19-23-73(36)59(84)42(27(2)3)64-55(45)80/h21-22,27-30,33-34,36,42-45,48-49H,18-20,23-26,62H2,1-17H3,(H,64,80)(H,65,81)(H,66,78)(H,67,79)/t30-,33+,34+,36-,42+,43+,44-,45-,48-,49-/m0/s1

InChIKey

VGAPFJVVEOUDPN-YRKRLMRRSA-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)[C@@H]6CCCN6C(=O)[C@H](NC5=O)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 2mg/kg (2mg/kg)   "CRC Handbook of Antibiotic Compounds," Vols.1- , Berdy, J., Boca Raton, FL, CRC Press, 1980Vol. 4(2), Pg. 66, 1980.
mouse LD50 intravenous 5mg/kg (5mg/kg)   "Structure-Activity Relationship among the Semisynthetic Antibiotics," Perlman, D., ed., New York, Academic Press, 1977Vol. -, Pg. 427, 1977.