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Substance Name: 2,7-(Epoxypentadeca(1,11,13)trienimino)naphtho(2,1-b)furan-1,11(2H)-dione, 2,4,12,16,18,20,22-heptamethyl-5,6,9,17,19,21-hexahydroxy-23-methoxy- 8-(4-methyl-1-piperazinyl)-, 21-acetate
RN: 17555-08-7
InChIKey: ZEYYVXQBWOTCFV-IFMBJELPSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C42-H56-N3-O12

Molecular Weight

  • 795.9213
 
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Names and Synonyms

  • 2,7-(Epoxypentadeca(1,11,13)trienimino)naphtho(2,1-b)furan-1,11(2H)-dione, 2,4,12,16,18,20,22-heptamethyl-5,6,9,17,19,21-hexahydroxy-23-methoxy- 8-(4-methyl-1-piperazinyl)-, 21-acetate

Registry Numbers

CAS Registry Number

  • 17555-08-7

System Generated Number

  • 0017555087

Structure Descriptors

InChI

1S/C42H57N3O12/c1-20-12-11-13-21(2)41(53)43-31-32(45-17-15-44(9)16-18-45)37(51)28-29(36(31)50)35(49)25(6)39-30(28)40(52)42(8,57-39)55-19-14-27(54-10)22(3)38(56-26(7)46)24(5)34(48)23(4)33(20)47/h11-14,19-20,22-24,27,33-34,38,47-51H,15-18H2,1-10H3,(H,43,53)/b12-11+,19-14+,21-13-

InChIKey

ZEYYVXQBWOTCFV-IFMBJELPSA-N

Smiles

Cc1c(c2c3c4c1OC(C4=O)(O/C=C/C(C(C(C(C(C(C(C(/C=C/C=C(\C(=O)Nc(c2O)c(c3O)N5CCN(CC5)C)/C)C)O)C)O)C)OC(=O)C)C)OC)C)O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intravenous 255mg/kg (255mg/kg)   Antimicrobial Agents and Chemotherapy Vol. -, Pg. 359, 1966.