Chem
J-GLOBAL ID：200907041852845536   Nikkaji number：J867.976B

N-Glucosylmonascorubramine

N-グルコシルモナスコルブラミン
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： C29H37NO9
Molecular formula furigana： C29-H37-N-O9
Molecular weight： 543.613
InChI： InChI=1S/C29H37NO9/c1-4-6-7-8-9-11-20(32)22-19-13-16-12-17(10-5-2)30(14-18(16)26(36)29(19,3)39-28(22)37)27-25(35)24(34)23(33)21(15-31)38-27/h5,10,12-14,21,23-25,27,31,33-35H,4,6-9,11,15H2,1-3H3/b10-5+/t21-,23-,24+,25-,27?,29-/m1/s1
InChI key： PVGVJRPGIMWEKM-IQGKOCHUSA-N
SMILES： CCCCCCCC(=O)C1=C2C=c3cc(/C=C/C)n(cc3C(=O)[C@]2(C)OC1=O)C1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O
Systematic name  (3)：
  • (9aR)-3-(1-オキソオクチル)-6-[(E)-1-プロペニル]-7-(D-グルコピラノシル)-9a-メチルフロ[3,2-g]イソキノリン-2,9(7H,9aH)-ジオン
  • (9aR)-9a-メチル-3-オクタノイル-6-[(1E)-プロパ-1-エン-1-イル]-7-[(3R,4S,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]-2H,7H,9H,9aH-フロ[3,2-g]イソキノリン-2,9-ジオン
  • (9aR)-9a-methyl-3-octanoyl-6-[(1E)-prop-1-en-1-yl]-7-[(3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]-2H,7H,9H,9aH-furo[3,2-g]isoquinoline-2,9-dione
Other name (3)：
  • N-グルコシルモナスコルブラミン
  • N-Glucosylmonascorubramine
  • (9aR)-3-(1-Oxooctyl)-6-[(E)-1-propenyl]-7-(D-glucopyranosyl)-9a-methylfuro[3,2-g]isoquinoline-2,9(7H,9aH)-dione
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