Chem
J-GLOBAL ID：200907026002547847   Nikkaji number：J925.155C

(4S)-4β-Acetoxy-4-ethyl-10-(2-O,3-O,4-O,6-O-tetraacetyl-β-D-glucopyranosyloxy)-1H-pyrano[3′,4′:6,7]indolizino[1,2-b]quinoline-3,14(4H,12H)-dione

(4S)-4β-アセトキシ-4-エチル-10-(2-O,3-O,4-O,6-O-テトラアセチル-β-D-グルコピラノシルオキシ)-1H-ピラノ[3′,4′:6,7]インドリジノ[1,2-b]キノリン-3,14(4H,12H)-ジオン
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： C36H36N2O15
Molecular formula furigana： C36-H36-N2-O15
Molecular weight： 736.683
InChI： InChI=1S/C36H36N2O15/c1-7-36(53-20(6)43)24-12-26-29-21(13-38(26)33(44)23(24)14-47-35(36)45)11-22-25(37-29)9-8-10-27(22)51-34-32(50-19(5)42)31(49-18(4)41)30(48-17(3)40)28(52-34)15-46-16(2)39/h8-12,28,30-32,34H,7,13-15H2,1-6H3/t28-,30-,31+,32-,34-,36+/m1/s1
InChI key： PTFWVXMQJAPDPA-UPCIXNIPSA-N
SMILES： CC[C@@]1(OC(=O)C)C(=O)OCc2c1cc1c3nc4cccc(O[C@@H]5O[C@H](COC(=O)C)[C@@H](OC(=O)C)[C@H](OC(=O)C)[C@H]5OC(=O)C)c4cc3Cn1c2=O
Systematic name  (3)：
  • (4S)-4β-アセトキシ-4-エチル-10-(2-O,3-O,4-O,6-O-テトラアセチル-β-D-グルコピラノシルオキシ)-1H-ピラノ[3′,4′:6,7]インドリジノ[1,2-b]キノリン-3,14(4H,12H)-ジオン
  • [(2R,3R,4S,5R,6S)-3,4,5-トリス(アセチルオキシ)-6-{[(19S)-19-(アセチルオキシ)-19-エチル-14,18-ジオキソ-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-1(21),2(11),3,5,7,9,15(20)-ヘプタエン-8-イル]オキシ}オキサン-2-イル]メチル アセタート
  • [(2R,3R,4S,5R,6S)-3,4,5-tris(acetyloxy)-6-{[(19S)-19-(acetyloxy)-19-ethyl-14,18-dioxo-17-oxa-3,13-diazapentacyclo[11.8.0.02,11.04,9.015,20]henicosa-1(21),2(11),3,5,7,9,15(20)-heptaen-8-yl]oxy}oxan-2-yl]methyl acetate
Other name (1)：
  • (4S)-4β-Acetoxy-4-ethyl-10-(2-O,3-O,4-O,6-O-tetraacetyl-β-D-glucopyranosyloxy)-1H-pyrano[3′,4′:6,7]indolizino[1,2-b]quinoline-3,14(4H,12H)-dione
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