Chem
J-GLOBAL ID：200907043790239653   Nikkaji number：J360.564G

(4S)-4α-Ethyl-4,12-dihydro-4,9-dihydroxy-10-(2-dimethylaminoethylthiomethyl)-1H-pyrano[3′,4′:6,7]indolizino[1,2-b]quinoline-3,14-dione

(4S)-4α-エチル-4,12-ジヒドロ-4,9-ジヒドロキシ-10-(2-ジメチルアミノエチルチオメチル)-1H-ピラノ[3′,4′:6,7]インドリジノ[1,2-b]キノリン-3,14-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： C25H27N3O5S
Molecular formula furigana： C25-H27-N3-O5-S
Molecular weight： 481.570
InChI： InChI=1S/C25H27N3O5S/c1-4-25(32)18-10-20-22-14(11-28(20)23(30)16(18)12-33-24(25)31)9-15-17(13-34-8-7-27(2)3)21(29)6-5-19(15)26-22/h5-6,9-10,29,32H,4,7-8,11-13H2,1-3H3/t25-/m0/s1
InChI key： KTTXTDYMGRYEAS-VWLOTQADSA-N
SMILES： CC[C@@]1(O)C(=O)OCc2c1cc1c3nc4ccc(O)c(CSCCN(C)C)c4cc3Cn1c2=O
Systematic name  (3)：
  • (4S)-4α-エチル-4,12-ジヒドロ-4,9-ジヒドロキシ-10-(2-ジメチルアミノエチルチオメチル)-1H-ピラノ[3′,4′:6,7]インドリジノ[1,2-b]キノリン-3,14-ジオン
  • (19S)-8-({[2-(ジメチルアミノ)エチル]スルファニル}メチル)-19-エチル-7,19-ジヒドロキシ-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-1(21),2(11),3,5,7,9,15(20)-ヘプタエン-14,18-ジオン
  • (19S)-8-({[2-(dimethylamino)ethyl]sulfanyl}methyl)-19-ethyl-7,19-dihydroxy-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)-heptaene-14,18-dione
Other name (1)：
  • (4S)-4α-Ethyl-4,12-dihydro-4,9-dihydroxy-10-(2-dimethylaminoethylthiomethyl)-1H-pyrano[3′,4′:6,7]indolizino[1,2-b]quinoline-3,14-dione
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