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Substance Name: Nogalamycin-N-oxide
RN: 64457-65-4
InChIKey: HOGCKQSCNDDSFJ-UHFFFAOYSA-N

Classification Code

  • Mutation Data

Molecular Formula

  • C39-H49-N-O17

Molecular Weight

  • 803.8061
 
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Names and Synonyms

Results Name

  • Nogalamycin-N-oxide

Synonym

  • Nogalamycin-N-oxide

Systematic Name

  • 2,6-Epoxy-2H-naphthaceno(1,2-b)oxocin-14-carboxylic acid, 11-((6-deoxy-3-C-methyl-2,3,4-tri-O-methyl-alpha-L-mannopyranosyl)oxy)-4-(dimethylamino)-3,4,5,6,9,11,12,13,14,16-decahydro-3,5,8,10,13-pentahydroxy-6,13-dimethyl-9,16-dioxo-, methyl ester, N-oxide, (2-alpha,3-beta,4-alpha,5-beta,6-alpha,11-beta,13-alpha,14-alpha)-(+)-

Registry Numbers

CAS Registry Number

  • 64457-65-4

System Generated Number

  • 0064457654

Structure Descriptors

InChI

1S/C39H49NO17/c1-14-32(50-7)39(4,53-10)33(51-8)36(54-14)55-19-13-37(2,48)24(34(47)52-9)15-11-16-21(27(43)20(15)19)28(44)22-18(41)12-17-30(23(22)26(16)42)56-35-29(45)25(40(5,6)49)31(46)38(17,3)57-35/h11-12,14,19,24-25,29,31-33,35-36,41,43,45-46,48H,13H2,1-10H3

InChIKey

HOGCKQSCNDDSFJ-UHFFFAOYSA-N

Smiles

CC1C(C(C(C(O1)OC2CC(C(c3c2c(c4c(c3)C(=O)c5c(c(cc6c5OC7C(C(C(C6(O7)C)O)N(=O)(C)C)O)O)C4=O)O)C(=O)OC)(C)O)OC)(C)OC)OC