Chem
J-GLOBAL ID：200907046457378335   Nikkaji number：J203.789K

Bafilomycin A1

バフィロマイシンA1
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： C35H58O9
Molecular formula furigana： C35-H58-O9
Molecular weight： 622.840
InChI： InChI=1S/C35H58O9/c1-19(2)32-24(7)27(36)18-35(40,44-32)26(9)31(38)25(8)33-28(41-10)14-12-13-20(3)15-22(5)30(37)23(6)16-21(4)17-29(42-11)34(39)43-33/h12-14,16-17,19,22-28,30-33,36-38,40H,15,18H2,1-11H3
InChI key： XDHNQDDQEHDUTM-UHFFFAOYSA-N
SMILES： COC1C=CC=C(C)CC(C)C(O)C(C)C=C(C)C=C(OC)C(=O)OC1C(C)C(O)C(C)C1(O)CC(O)C(C)C(O1)C(C)C
Systematic name  (4)：
  • 21-O-デ(3-カルボキシ-1-オキソ-2-プロペニル)-2-デメチル-2-メトキシ-24-メチルヒグロリジン
  • 21-O-デス(3-カルボキシ-1-オキソ-2-プロペニル)-2-デメチル-2-メトキシ-24-メチルヒグロリジン
  • 16-{4-[2,4-ジヒドロキシ-5-メチル-6-(プロパン-2-イル)オキサン-2-イル]-3-ヒドロキシペンタン-2-イル}-8-ヒドロキシ-3,15-ジメトキシ-5,7,9,11-テトラメチル-1-オキサシクロヘキサデカ-3,5,11,13-テトラエン-2-オン
  • 16-{4-[2,4-dihydroxy-5-methyl-6-(propan-2-yl)oxan-2-yl]-3-hydroxypentan-2-yl}-8-hydroxy-3,15-dimethoxy-5,7,9,11-tetramethyl-1-oxacyclohexadeca-3,5,11,13-tetraen-2-one
Other name (6)：
  • バフィロマイシンA1
  • Bafilomycin A1
  • 21-O-De(3-carboxy-1-oxo-2-propenyl)-2-demethyl-2-methoxy-24-methylhygrolidin
  • 21-O-Des(3-carboxy-1-oxo-2-propenyl)-2-demethyl-2-methoxy-24-methylhygrolidin
  • バフィロマイシンA1
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CAS registry number： 88899-55-2
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