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Substance Name: 4-O-Methyl-13-hydroxyoxaunomycin
RN: 127995-99-7
InChIKey: CCPABUFJGOJNIN-UHFFFAOYSA-N

Molecular Formula

  • C27-H31-N-O10

Molecular Weight

  • 529.5389
 
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Names and Synonyms

Name of Substance

  • 4-O-Methyl-13-hydroxyoxaunomycin

Synonym

  • (7R-(7alpha,8beta,10beta))-10-((3-Amino-2,3,6-trideoxy-alpha-L-lyxo-hexopyranosyl)oxy)-8-ethyl-7,8,9,10-tetrahydro-6,7,8,11-tetrahydroxy-1-methoxy-5,12-naphthacenedione

Systematic Name

  • 5,12-Naphthacenedione, 10-((3-amino-2,3,6-trideoxy-alpha-L-lyxo-hexopyranosyl)oxy)-8-ethyl-7,8,9,10-tetrahydro-6,7,8,11-tetrahydroxy-1-methoxy-, (7R-(7alpha,8beta,10beta))-

Registry Numbers

CAS Registry Number

  • 127995-99-7

System Generated Number

  • 0127995997

Structure Descriptors

InChI

1S/C27H31NO10/c1-4-27(35)9-14(38-15-8-12(28)21(29)10(2)37-15)17-20(26(27)34)25(33)18-19(24(17)32)23(31)16-11(22(18)30)6-5-7-13(16)36-3/h5-7,10,12,14-15,21,26,29,32-35H,4,8-9,28H2,1-3H3

InChIKey

CCPABUFJGOJNIN-UHFFFAOYSA-N

Smiles

CCC1(CC(c2c(c(c3c(c2O)C(=O)c4c(cccc4OC)C3=O)O)C1O)OC5CC(C(C(O5)C)O)N)O