Chem
J-GLOBAL ID：200907064831629817   Nikkaji number：J2.541.351B

Epicoccamide D

エピコッカミドD
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： C31H55NO8
Molecular formula furigana： C31-H55-N-O8
Molecular weight： 569.780
InChI： InChI=1S/C31H55NO8/c1-21(26(34)25-27(35)22(2)32(3)31(25)39)18-16-14-12-10-8-6-4-5-7-9-11-13-15-17-19-23-28(36)30(38)29(37)24(20-33)40-23/h21-24,28-30,33,36-39H,4-20H2,1-3H3/t21?,22?,23-,24+,28+,29+,30+/m0/s1
InChI key： SEQFNGYECBXDKD-PLCHDDIOSA-N
SMILES： CC(CCCCCCCCCCCCCCCC[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@@H]1O)C(=O)C1=C(O)N(C)C(C)C1=O
Systematic name  (3)：
  • 5-ヒドロキシ-1,2-ジメチル-4-[2-メチル-18-(β-D-マンノピラノシル)オクタデカノイル]-1H-ピロール-3(2H)-オン
  • 5-ヒドロキシ-1,2-ジメチル-4-{2-メチル-18-[(2S,3S,4R,5S,6R)-3,4,5-トリヒドロキシ-6-(ヒドロキシメチル)オキサン-2-イル]オクタデカノイル}-2,3-ジヒドロ-1H-ピロール-3-オン
  • 5-hydroxy-1,2-dimethyl-4-{2-methyl-18-[(2S,3S,4R,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]octadecanoyl}-2,3-dihydro-1H-pyrrol-3-one
Other name (3)：
  • 5-Hydroxy-1,2-dimethyl-4-[2-methyl-18-(β-D-mannopyranosyl)octadecanoyl]-1H-pyrrole-3(2H)-one
  • エピコッカミドD
  • Epicoccamide D
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