Chem
J-GLOBAL ID：200907091590146396   Nikkaji number：J589.906K

Chromomycin B

クロモマイシノン
Substance type：
Substance type
Substance type classified into 3 categories.
Decided structure: Substances with a clear structure
Undicided Structure: Substances with unknown or undetermined structure
Mixtures: Mixtures, racemic compounds, or compounds with relative structural arrangements
Decided structure
Molecular formula： C21H24O9
Molecular formula furigana： C21-H24-O9
Molecular weight： 420.414
InChI： InChI=1S/C21H24O9/c1-7-12(23)6-10-4-9-5-11(21(30-3)20(29)16(25)8(2)22)17(26)19(28)14(9)18(27)13(10)15(7)24/h4,6,8,11,16-17,21-27H,5H2,1-3H3/t8-,11-,16+,17+,21+/m1/s1
InChI key： AOCJXLJIUYHXRS-PKRZCTMMSA-N
SMILES： CO[C@@H]([C@@H]1Cc2cc3cc(O)c(C)c(O)c3c(O)c2C(=O)[C@H]1O)C(=O)[C@@H](O)[C@@H](C)O
Systematic name  (3)：
  • (2S)-3α-[(1S,3S,4R)-3,4-ジヒドロキシ-1-メトキシ-2-オキソペンチル]-3,4-ジヒドロ-2β,6,8,9-テトラヒドロキシ-7-メチルアントラセン-1(2H)-オン
  • (2S,3R)-3-[(1S,3S,4R)-3,4-ジヒドロキシ-1-メトキシ-2-オキソペンチル]-2,6,8,9-テトラヒドロキシ-7-メチル-1,2,3,4-テトラヒドロアントラセン-1-オン
  • (2S,3R)-3-[(1S,3S,4R)-3,4-dihydroxy-1-methoxy-2-oxopentyl]-2,6,8,9-tetrahydroxy-7-methyl-1,2,3,4-tetrahydroanthracen-1-one
Other name (5)：
  • クロモマイシンB
  • Chromomycin B
  • (2S)-3α-[(1S,3S,4R)-3,4-Dihydroxy-1-methoxy-2-oxopentyl]-3,4-dihydro-2β,6,8,9-tetrahydroxy-7-methylanthracen-1(2H)-one
  • クロモマイシノン
  • Chromomycinone
CAS registry number： 10183-93-4
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