Chem
J-GLOBAL ID:200907011469967249
Nikkaji number:J406.679K
(1R)-1,2,3,4-Tetrahydro-1β-[(R)-1-[(benzyloxycarbonyl)amino]-2-[(2,2,2-trichloroethoxycarbonyl)thio]ethyl]-β-carbolin-2-ol
(1R)-1,2,3,4-テトラヒドロ-1β-[(R)-1-[(ベンジルオキシカルボニル)アミノ]-2-[(2,2,2-トリクロロエトキシカルボニル)チオ]エチル]-β-カルボリン-2-オール
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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:
C24 H24 Cl3 N3 O5 S
Molecular formula furigana:
C24-H24-CL3-N3-O5-S
Molecular weight:
572.880
InChI:
InChI=1S/C24H24Cl3N3O5S/c25-24(26,27)14-35-23(32)36-13-19(29-22(31)34-12-15-6-2-1-3-7-15)21-20-17(10-11-30(21)33)16-8-4-5-9-18(16)28-20/h1-9,19,21,28,33H,10-14H2,(H,29,31)/t19-,21+/m0/s1
InChI key:
DVFRBPGNJYCRRN-PZJWPPBQSA-N
SMILES:
ON1CCc2c([nH]c3ccccc23)[C@H]1[C@H](CSC(=O)OCC(Cl)(Cl)Cl)NC(=O)OCc1ccccc1
Systematic name (3):
(1R)-1,2,3,4-テトラヒドロ-1β-[(R)-1-[(ベンジルオキシカルボニル)アミノ]-2-[(2,2,2-トリクロロエトキシカルボニル)チオ]エチル]-β-カルボリン-2-オール
{[(2R)-2-{[(ベンジルオキシ)カルボニル]アミノ}-2-[(1R)-2-ヒドロキシ-1H,2H,3H,4H,9H-ピリド[3,4-b]インドール-1-イル]エチル]スルファニル}(2,2,2-トリクロロエトキシ)メタノン
{[(2R)-2-{[(benzyloxy)carbonyl]amino}-2-[(1R)-2-hydroxy-1H,2H,3H,4H,9H-pyrido[3,4-b]indol-1-yl]ethyl]sulfanyl}(2,2,2-trichloroethoxy)methanone
Other name (1):
(1R)-1,2,3,4-Tetrahydro-1β-[(R)-1-[(benzyloxycarbonyl)amino]-2-[(2,2,2-trichloroethoxycarbonyl)thio]ethyl]-β-carbolin-2-ol
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