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Substance Name: Antibiotic MA 144L1
RN: 64431-58-9
UNII: R992SD6O2C
InChIKey: AQTCLQLBOGABRV-UFJKXKKKSA-N

Classification Code

  • Mutation Data

Molecular Formula

  • C41-H51-N-O15

Molecular Weight

  • 797.846
 
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Names and Synonyms

Results Name

  • Antibiotic MA 144L1

Name of Substance

  • N-Monodemethylaclacinomycin A

Synonyms

  • Antibiotic MA 144L1
  • MA 144L1
  • N-Demethylaclacinomycin A
  • N-Monodemethylaclacinomycin A
  • UNII-R992SD6O2C

Systematic Name

  • 1-Naphthacenecarboxylic acid, 1,2,3,4,6,11-hexahydro-6,11-dioxo-2-ethyl-4-((2,3,6-trideoxy-4-O-(2,6-dideoxy-4-O-((2R-trans)-tetrahydro-6-methyl-5-oxo-2H-pyran-2-yl)-alpha-L-lyxo-hexopyranosyl)-3-(methylamino)-alpha-L-lyxo-hexopyranosyl)oxy)-2,5,7-trihydroxy-, methyl ester, (1R-(1-alpha,2-beta,4-beta))-

Registry Numbers

CAS Registry Number

  • 64431-58-9

FDA UNII

  • R992SD6O2C

System Generated Number

  • 0064431589

Structure Descriptors

InChI

1S/C41H51NO15/c1-7-41(50)16-27(32-21(34(41)40(49)51-6)13-22-33(37(32)48)36(47)31-20(35(22)46)9-8-10-25(31)44)55-29-14-23(42-5)38(18(3)53-29)57-30-15-26(45)39(19(4)54-30)56-28-12-11-24(43)17(2)52-28/h8-10,13,17-19,23,26-30,34,38-39,42,44-45,48,50H,7,11-12,14-16H2,1-6H3/t17-,18-,19-,23-,26-,27-,28-,29-,30-,34-,38+,39+,41+/m0/s1

InChIKey

AQTCLQLBOGABRV-UFJKXKKKSA-N

Smiles

C1[C@H](O[C@H]2[C@@H](O)C[C@H](O[C@H]3[C@H](C[C@H](O[C@@H]4c5c(O)c6c(cc5[C@@H](C(=O)OC)[C@@](O)(CC)C4)C(=O)c4c(c(O)ccc4)C6=O)O[C@H]3C)NC)O[C@H]2C)O[C@H](C(C1)=O)C

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 45500ug/kg (45.5mg/kg)   Japanese Kokai Tokyo Koho Patents. Vol. #78-44555,