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Substance Name: Epoxykidamycin
RN: 99237-11-3
InChIKey: PVJYYBPEVWDBNV-UHFFFAOYSA-N

Note

  • Component 4 of the chromophore of largomycin FII.

Molecular Formula

  • C39-H48-N2-O10

Molecular Weight

  • 704.812
 
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Names and Synonyms

Name of Substance

  • Epoxykidamycin

Systematic Name

  • 4H-Anthra(1,2-b)pyran-4,7,12-trione, 2-(2,3-dimethyloxiranyl)-11-hydroxy-5-methyl-8-(2,3,6-trideoxy-3-(dimethylamino)-beta-D-arabino-hexopyranosyl)-10-(2,3,6-trideoxy-3-(dimethylamino)-3-C-methyl-alpha-L-lyxo-hexopyranosyl)-

Registry Numbers

CAS Registry Number

  • 99237-11-3

System Generated Number

  • 0099237113

Structure Descriptors

InChI

1S/C39H48N2O10/c1-16-11-21-30(36-28(16)24(43)14-27(50-36)39(6)19(4)51-39)35(46)31-23(42)12-20(26-15-38(5,41(9)10)37(47)18(3)49-26)29(32(31)34(21)45)25-13-22(40(7)8)33(44)17(2)48-25/h11-12,14,17-19,22,25-26,33,37,42,44,47H,13,15H2,1-10H3

InChIKey

PVJYYBPEVWDBNV-UHFFFAOYSA-N

Smiles

C1[C@@](N(C)C)([C@@H]([C@@H](C)O[C@@H]1c1c(c2c(c(c1)O)C(c1c3c(c(C)cc1C2=O)c(cc(o3)[C@@]1(O[C@@H]1C)C)=O)=O)[C@@H]1C[C@@H]([C@@H]([C@@H](O1)C)O)N(C)C)O)C