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Substance Name: 3'-Hydroxyesorubicin
RN: 130592-19-7
InChIKey: TZBDURDLNXOXBK-BMFNZSJVSA-N

Note

  • Synthetic antibiotic.

Molecular Formula

  • C27-H28-O11

Molecular Weight

  • 528.5072
 
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Names and Synonyms

Name of Substance

  • 3'-Hydroxyesorubicin

Synonym

  • (2S-(2alpha(8R*,10R*),4beta,6beta))-7,8,9,10-Tetrahydro-6,8,11-trihydroxy-8-(hydroxyacetyl)-1-methoxy-10-((tetrahydro-4-hydroxy-6-methyl-2H-pyran-2-yl)oxy)-5,12-naphthacenedione

Systematic Name

  • 5,12-Naphthacenedione, 7,8,9,10-tetrahydro-6,8,11-trihydroxy-8-(hydroxyacetyl)-1-methoxy-10-((tetrahydro-4-hydroxy-6-methyl-2H-pyran-2-yl)oxy)-, (2S-(2alpha(8R*,10R*),4beta,6beta))-

Registry Numbers

CAS Registry Number

  • 130592-19-7

System Generated Number

  • 0130592197

Structure Descriptors

InChI

1S/C27H28O11/c1-11-6-12(29)7-18(37-11)38-16-9-27(35,17(30)10-28)8-14-20(16)26(34)22-21(24(14)32)23(31)13-4-3-5-15(36-2)19(13)25(22)33/h3-5,11-12,16,18,28-29,32,34-35H,6-10H2,1-2H3/t11-,12+,16-,18-,27-/m0/s1

InChIKey

TZBDURDLNXOXBK-BMFNZSJVSA-N

Smiles

C[C@H]1C[C@H](C[C@@H](O1)O[C@H]2C[C@@](Cc3c2c(c4c(c3O)C(=O)c5cccc(c5C4=O)OC)O)(C(=O)CO)O)O