Chem
J-GLOBAL ID：201107063088138961   Nikkaji number：J2.900.395E

Bisleuconothine A

ビスロイコノチンA
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： C38H48N4O
Molecular formula furigana： C38-H48-N4-O
Molecular weight： 576.829
InChI： InChI=1S/C38H48N4O/c1-3-36-15-7-20-41-22-18-38(35(36)41)30(13-17-36)39-32-26(11-12-29(43)31(32)38)28-23-37(4-2)16-8-19-40-21-14-25-24-9-5-6-10-27(24)42(28)33(25)34(37)40/h5-6,9-12,28,30,34-35,39,43H,3-4,7-8,13-23H2,1-2H3/t28-,30+,34-,35+,36+,37+,38-/m0/s1
InChI key： HHCOPHVLECRPRE-UQYJQATHSA-N
SMILES： CC[C@@]12CCCN3CC[C@@]4([C@@H](CC1)Nc1c4c(O)ccc1[C@@H]1C[C@@]4(CC)CCCN5CCc6c([C@@H]45)n1c1ccccc61)[C@@H]23
Systematic name  (3)：
  • (4aR)-4aβ-エチル-8-[(1R)-1α-エチル-1,11-エタノ-1,2,3,4,5,6,11,11bα-オクタヒドロ-4a,11-ジアザ-4aH-ベンゾ[a]フルオレン-12α-イル]-1,11bα-エタノ-2,3,4,4a,5,6,6aα,7,11b,11cβ-デカヒドロ-1H-ピリド[3,2-c]カルバゾール-11-オール
  • (1R,9R,12R,19R)-12-エチル-6-[(15R,17S,19R)-15-エチル-1,11-ジアザペンタシクロ[9.6.2.02,7.08,18.015,19]ノナデカ-2,4,6,8(18)-テトラエン-17-イル]-8,16-ジアザペンタシクロ[10.6.1.01,9.02,7.016,19]ノナデカ-2(7),3,5-トリエン-3-オール
  • (1R,9R,12R,19R)-12-ethyl-6-[(15R,17S,19R)-15-ethyl-1,11-diazapentacyclo[9.6.2.02,7.08,18.015,19]nonadeca-2,4,6,8(18)-tetraen-17-yl]-8,16-diazapentacyclo[10.6.1.01,9.02,7.016,19]nonadeca-2(7),3,5-trien-3-ol
Other name (3)：
  • (4aR)-4aβ-Ethyl-8-[(1R)-1α-ethyl-1,11-ethano-1,2,3,4,5,6,11,11bα-octahydro-4a,11-diaza-4aH-benzo[a]fluorene-12α-yl]-1,11bα-ethano-2,3,4,4a,5,6,6aα,7,11b,11cβ-decahydro-1H-pyrido[3,2-c]carbazole-11-ol
  • ビスロイコノチンA
  • Bisleuconothine A
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