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Substance Name: Axenomycin B
RN: 41975-84-2
InChIKey: JFHASUPBUKOUIB-UHFFFAOYSA-N

Classification Codes

  • Drug / Therapeutic Agent
  • Natural Product

Molecular Formula

  • C78-H126-O30

Molecular Weight

  • 1561.8382
 
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Names and Synonyms

Synonyms

  • Antibiotic FJ 2604 B
  • FJ-2604-B

Systematic Name

  • Axenomycin B

Registry Numbers

CAS Registry Number

  • 41975-84-2

System Generated Number

  • 0041975842

Structure Descriptors

InChI

1S/C50H92O21.C28H36O10/c1-8-37(57)26(4)43(63)27(5)44(64)28(6)45(65)29(7)47-46(66)38(58)14-10-13-31(52)17-33(54)18-34(55)19-35(56)20-36-22-41(61)50(69,49(68)70-36)48(67)24(2)15-16-30(51)11-9-12-32(53)21-39(59)25(3)40(60)23-42(62)71-47;1-13-10-20(29)19-11-17(6-7-18(19)24(13)31)25(32)14(2)27(33)37-21-8-9-23(36-15(21)3)38-26-16(4)35-22(30)12-28(26,5)34/h24-40,43-48,51-60,63-67,69H,8-23H2,1-7H3;6-7,10-11,14-16,21-23,25-26,30,32,34H,8-9,12H2,1-5H3

InChIKey

JFHASUPBUKOUIB-UHFFFAOYSA-N

Smiles

c1c(ccc2c1C(=O)C=C(C2=O)C)C(C(C(=O)OC1C(OC(CC1)OC1C(C)OC(CC1(O)C)O)C)C)O.C1C(CC(CC(CC(CCCC(C(C(OC(=O)CC(C(C(CC(CCCC(CCC(C(C2(C(=O)CC1OC2=O)O)O)C)O)O)O)C)O)C(C)C(O)C(C(O)C(C(O)C(C(O)CC)C)C)C)O)O)O)O)O)O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intravenous 10mg/kg (10mg/kg)   "CRC Handbook of Antibiotic Compounds," Vols.1- , Berdy, J., Boca Raton, FL, CRC Press, 1980Vol. 2, Pg. 336, 1980.
mouse LD50 oral 300mg/kg (300mg/kg)   "CRC Handbook of Antibiotic Compounds," Vols.1- , Berdy, J., Boca Raton, FL, CRC Press, 1980Vol. 2, Pg. 336, 1980.