Chem
J-GLOBAL ID：200907085123435457   Nikkaji number：J360.557D

(4S)-4α-Ethyl-4,12-dihydro-4,9-dihydroxy-10-cyclohexylaminomethyl-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-シクロヘキシルアミノメチル-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： C27H29N3O5
Molecular formula furigana： C27-H29-N3-O5
Molecular weight： 475.545
InChI： InChI=1S/C27H29N3O5/c1-2-27(34)20-11-22-24-15(13-30(22)25(32)19(20)14-35-26(27)33)10-17-18(23(31)9-8-21(17)29-24)12-28-16-6-4-3-5-7-16/h8-11,16,28,31,34H,2-7,12-14H2,1H3/t27-/m0/s1
InChI key： FYIHCJZMJODENF-MHZLTWQESA-N
SMILES： CC[C@@]1(O)C(=O)OCc2c1cc1c3nc4ccc(O)c(CNC5CCCCC5)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-シクロヘキシルアミノメチル-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-[(シクロヘキシルアミノ)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-[(cyclohexylamino)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-cyclohexylaminomethyl-1H-pyrano[3′,4′:6,7]indolizino[1,2-b]quinoline-3,14-dione
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