Chem
J-GLOBAL ID:200907002387273770   Nikkaji number:J873.870J

(2S,3R)-2,3-Dihydroxy-3-phenylpropionic acid [(4S)-4-ethyl-3,14-dioxo-3,4,12,14-tetrahydro-1H-pyrano[3′,4′:6,7]indolizino[1,2-b]quinolin]-4β-yl ester

(2S,3R)-2,3-ジヒドロキシ-3-フェニルプロピオン酸[(4S)-4-エチル-3,14-ジオキソ-3,4,12,14-テトラヒドロ-1H-ピラノ[3′,4′:6,7]インドリジノ[1,2-b]キノリン]-4β-イル
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: C29H24N2O7
Molecular formula furigana: C29-H24-N2-O7
Molecular weight: 512.518
InChI: InChI=1S/C29H24N2O7/c1-2-29(38-27(35)25(33)24(32)16-8-4-3-5-9-16)20-13-22-23-18(12-17-10-6-7-11-21(17)30-23)14-31(22)26(34)19(20)15-37-28(29)36/h3-13,24-25,32-33H,2,14-15H2,1H3/t24-,25+,29+/m1/s1
InChI key: BJRXTCFTIWBRMN-AHPZMPFVSA-N
SMILES: CC[C@@]1(OC(=O)[C@@H](O)[C@H](O)c2ccccc2)C(=O)OCc2c1cc1c3nc4ccccc4cc3Cn1c2=O
Systematic name  (3):
  • (2S,3R)-2,3-ジヒドロキシ-3-フェニルプロピオン酸[(4S)-4-エチル-3,14-ジオキソ-3,4,12,14-テトラヒドロ-1H-ピラノ[3′,4′:6,7]インドリジノ[1,2-b]キノリン]-4β-イル
  • (19S)-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-19-イル (2S,3R)-2,3-ジヒドロキシ-3-フェニルプロパノアート
  • (19S)-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-19-yl (2S,3R)-2,3-dihydroxy-3-phenylpropanoate
Other name (1):
  • (2S,3R)-2,3-Dihydroxy-3-phenylpropionic acid [(4S)-4-ethyl-3,14-dioxo-3,4,12,14-tetrahydro-1H-pyrano[3′,4′:6,7]indolizino[1,2-b]quinolin]-4β-yl ester
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