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Substance Name: 4-Hydroxybaumycinol A2
RN: 78919-31-0
InChIKey: QSLSPJFMOXHLJX-UHFFFAOYSA-N

Molecular Formula

  • C33-H43-N-O13

Molecular Weight

  • 661.697
 
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Names and Synonyms

Results Name

  • 4-Hydroxybaumycinol A2

Synonyms

  • 10-((3-Amino-2,3,6-trideoxy-4-O-(3-hydroxy-1-(2-hydroxy-1-methylethoxy)butyl)-alpha-L-lyxo-hexopyranosyl)oxy)-7,8,9,10-tetrahydro-1,6,8,11-tetrahydroxy-8-(1-hydroxyethyl)-5,12-naphthacenedione
  • 4-Hydroxybaumycinol A1

Systematic Name

  • 5,12-Naphthacenedione, 10-((3-amino-2,3,6-trideoxy-4-O-(3-hydroxy-1-(2-hydroxy-1-methylethoxy)butyl)-alpha-L-lyxo-hexopyranosyl)oxy)-7,8,9,10-tetrahydro-1,6,8,11-tetrahydroxy-8-(1-hydroxyethyl)-

Registry Numbers

CAS Registry Number

  • 78919-31-0

System Generated Number

  • 0078919310

Structure Descriptors

InChI

1S/C33H43NO13/c1-13(36)8-22(44-14(2)12-35)47-32-15(3)45-23(9-19(32)34)46-21-11-33(43,16(4)37)10-18-25(21)31(42)27-26(29(18)40)28(39)17-6-5-7-20(38)24(17)30(27)41/h5-7,13-16,19,21-23,32,35-38,40,42-43H,8-12,34H2,1-4H3

InChIKey

QSLSPJFMOXHLJX-UHFFFAOYSA-N

Smiles

C1[C@@H](O[C@@H]([C@@H](O[C@@H](C[C@@H](C)O)O[C@@H](CO)C)[C@@H]1N)C)O[C@@H]1c2c(c3C(c4c(O)cccc4C(c3c(c2C[C@@]([C@@H](O)C)(O)C1)O)=O)=O)O