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Substance Name: Rubomycin M
RN: 81703-98-2
UNII: M96ZG4YZ5M
InChIKey: QTGKDZKONUUXOU-RPYJURNCSA-N

Molecular Formula

  • C33-H39-N-O13

Molecular Weight

  • 657.6651
 
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Names and Synonyms

Name of Substance

  • Rubomycin M

Synonyms

  • 5,12-Naphthacenedione, 8-acetyl-10-((3-amino-2,3,6-trideoxy-4-O-(2,6-dideoxy-alpha-L-lyxo-hexopyranosyl)-alpha-L-lyxo-hexopyranosyl)oxy)-7,8,9,10-tetrahydro-6,8,11-trihydroxy-1-methoxy-, (8S,10S)-
  • 5,12-Naphthacenedione, 8-acetyl-10-((3-amino-2,3,6-trideoxy-4-O-(2,6-dideoxy-alpha-L-lyxo-hexopyranosyl)-alpha-L-lyxo-hexopyranosyl)oxy)-7,8,9,10-tetrahydro-6,8,11-trihydroxy-1-methoxy-, (8S-cis)-
  • Mar-70
  • Rubomycin M
  • UNII-M96ZG4YZ5M

Registry Numbers

CAS Registry Number

  • 81703-98-2

FDA UNII

  • M96ZG4YZ5M

System Generated Number

  • 0081703982

Structure Descriptors

InChI

1S/C33H39NO13/c1-12-27(37)18(36)9-22(44-12)47-32-13(2)45-21(8-17(32)34)46-20-11-33(42,14(3)35)10-16-24(20)31(41)26-25(29(16)39)28(38)15-6-5-7-19(43-4)23(15)30(26)40/h5-7,12-13,17-18,20-22,27,32,36-37,39,41-42H,8-11,34H2,1-4H3/t12-,13-,17-,18-,20-,21-,22-,27+,32+,33-/m0/s1

InChIKey

QTGKDZKONUUXOU-RPYJURNCSA-N

Smiles

COc1cccc2C(=O)c3c(O)c4C[C@](O)(C[C@H](O[C@H]5C[C@H](N)[C@H](O[C@H]6C[C@H](O)[C@H](O)[C@H](C)O6)[C@H](C)O5)c4c(O)c3C(=O)c12)C(=O)C