Chem
J-GLOBAL ID：200907054142217611   Nikkaji number：J705.746F

Pumiloside

プミロシド
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： C26H28N2O9
Molecular formula furigana： C26-H28-N2-O9
Molecular weight： 512.515
InChI： InChI=1S/C26H28N2O9/c1-2-26(34)15-8-17-19-13(7-12-5-3-4-6-16(12)27-19)9-28(17)23(33)14(15)11-35-25(26)37-24-22(32)21(31)20(30)18(10-29)36-24/h2-7,11,15,17-18,20-22,24-25,29-32,34H,1,8-10H2/t15-,17+,18-,20-,21+,22-,24+,25+,26+/m1/s1
InChI key： CMLUTPKMPFDRAX-JNSIEVRQSA-N
SMILES： OC[C@H]1O[C@@H](O[C@@H]2OC=C3[C@@H](C[C@@H]4N(Cc5cc6ccccc6nc45)C3=O)[C@@]2(O)C=C)[C@H](O)[C@@H](O)[C@@H]1O
Systematic name  (3)：
  • (3S)-3β-(β-D-グルコピラノシルオキシ)-4α-エテニル-4-ヒドロキシ-3,4,4aβ,5,5aα,12-ヘキサヒドロ-14H-ピラノ[3′,4′:6,7]インドリジノ[1,2-b]キノリン-14-オン
  • (1S,18S,19S,20R)-19-エテニル-19-ヒドロキシ-18-{[(2S,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]オキシ}-17-オキサ-3,13-ジアザペンタシクロ[11.8.0.02,11.04,9.015,20]ヘンイコサ-2(11),3,5,7,9,15-ヘキサエン-14-オン
  • (1S,18S,19S,20R)-19-ethenyl-19-hydroxy-18-{[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-17-oxa-3,13-diazapentacyclo[11.8.0.02,11.04,9.015,20]henicosa-2(11),3,5,7,9,15-hexaen-14-one
Other name (5)：
  • プミロシド
  • Pumiloside
  • (3S)-3β-(β-D-Glucopyranosyloxy)-4α-ethenyl-4-hydroxy-3,4,4aβ,5,5aα,12-hexahydro-14H-pyrano[3′,4′:6,7]indolizino[1,2-b]quinolin-14-one
  • 3(S)-プミロシド
  • 3(S)-Pumiloside
KEGG COMPOUND： C16723
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