Chem
J-GLOBAL ID：200907016464131233   Nikkaji number：J2.453.807I

(3aα,4aα,7aα,8aα)-9-[1-[2-(2-Pyridyl)hydrazono]ethyl]-8-methyl-2,6-bis(2-pyridylamino)-4-(benzoylamino)-4β,8β-ethenododecahydrobenzo[1,2-c:4,5-c′]dipyrrole-1,3,5,7-tetraone

(3aα,4aα,7aα,8aα)-9-[1-[2-(2-ピリジル)ヒドラゾノ]エチル]-8-メチル-2,6-ビス(2-ピリジルアミノ)-4-(ベンゾイルアミノ)-4β,8β-エテノドデカヒドロベンゾ[1,2-c:4,5-c′]ジピロール-1,3,5,7-テトラオン
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： C37H32N10O5
Molecular formula furigana： C37-H32-N10-O5
Molecular weight： 696.728
InChI： InChI=1S/C37H32N10O5/c1-21(42-43-24-14-6-9-17-38-24)23-20-37(41-31(48)22-12-4-3-5-13-22)29-27(32(49)46(34(29)51)44-25-15-7-10-18-39-25)36(23,2)28-30(37)35(52)47(33(28)50)45-26-16-8-11-19-40-26/h3-20,27-30H,1-2H3,(H,38,43)(H,39,44)(H,40,45)(H,41,48)/t27-,28+,29+,30-,36+,37-
InChI key： SJGXDGJWBMLNJY-VEUAJOEASA-N
SMILES： CC(=NNc1ccccn1)C1=C[C@@]2(NC(=O)c3ccccc3)[C@H]3[C@H](C(=O)N(Nc4ccccn4)C3=O)[C@@]1(C)[C@H]1[C@@H]2C(=O)N(Nc2ccccn2)C1=O
Systematic name  (3)：
  • (3aα,4aα,7aα,8aα)-9-[1-[2-(2-ピリジル)ヒドラゾノ]エチル]-8-メチル-2,6-ビス(2-ピリジルアミノ)-4-(ベンゾイルアミノ)-4β,8β-エテノドデカヒドロベンゾ[1,2-c:4,5-c′]ジピロール-1,3,5,7-テトラオン
  • N-[(1r,2R,6S,7s,8R,12S)-7-メチル-3,5,9,11-テトラオキソ-4,10-ビス[(ピリジン-2-イル)アミノ]-14-{1-[2-(ピリジン-2-イル)ヒドラジン-1-イリデン]エチル}-4,10-ジアザテトラシクロ[5.5.2.02,6.08,12]テトラデカ-13-エン-1-イル]ベンズアミド
  • N-[(1r,2R,6S,7s,8R,12S)-7-methyl-3,5,9,11-tetraoxo-4,10-bis[(pyridin-2-yl)amino]-14-{1-[2-(pyridin-2-yl)hydrazin-1-ylidene]ethyl}-4,10-diazatetracyclo[5.5.2.02,6.08,12]tetradec-13-en-1-yl]benzamide
Other name (1)：
  • (3aα,4aα,7aα,8aα)-9-[1-[2-(2-Pyridyl)hydrazono]ethyl]-8-methyl-2,6-bis(2-pyridylamino)-4-(benzoylamino)-4β,8β-ethenododecahydrobenzo[1,2-c:4,5-c′]dipyrrole-1,3,5,7-tetraone
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