Chem
J-GLOBAL ID：200907014612176362   Nikkaji number：J1.929.080H

(1R,3R,4S,7R,8R,11R)-3,11-Diphenyl-8-(4-methylphenyl)-4-methyl-9-oxa-2-oxa-10-thia-5-azatricyclo[5.2.2.01,5]undecane-6-one

(1R,3R,4S,7R,8R,11R)-4-メチル-8-(4-メチルフェニル)-3,11-ジフェニル-2,9-ジオキサ-10-チア-5-アザトリシクロ[5.2.2.01,5]ウンデカン-6-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： C27H25NO3S
Molecular formula furigana： C27-H25-N-O3-S
Molecular weight： 443.560
InChI： InChI=1S/C27H25NO3S/c1-17-13-15-20(16-14-17)24-22-25(21-11-7-4-8-12-21)32-27(31-24)28(26(22)29)18(2)23(30-27)19-9-5-3-6-10-19/h3-16,18,22-25H,1-2H3/t18-,22-,23-,24-,25-,27-/m0/s1
InChI key： DQVOESSVLNZFTO-RWXUZHKTSA-N
SMILES： C[C@H]1[C@H](O[C@@]23O[C@H]([C@@H]([C@@H](S2)c2ccccc2)C(=O)N13)c1ccc(C)cc1)c1ccccc1
Systematic name  (3)：
  • (1R,3R,4S,7R,8R,11R)-3,11-ジフェニル-8-(4-メチルフェニル)-4-メチル-9-オキサ-2-オキサ-10-チア-5-アザトリシクロ[5.2.2.01,5]ウンデカン-6-オン
  • (1R,3R,4S,7R,8R,11R)-4-メチル-8-(4-メチルフェニル)-3,11-ジフェニル-2,9-ジオキサ-10-チア-5-アザトリシクロ[5.2.2.01,5]ウンデカン-6-オン
  • (1R,3R,4S,7R,8R,11R)-4-methyl-8-(4-methylphenyl)-3,11-diphenyl-2,9-dioxa-10-thia-5-azatricyclo[5.2.2.01,5]undecan-6-one
Other name (1)：
  • (1R,3R,4S,7R,8R,11R)-3,11-Diphenyl-8-(4-methylphenyl)-4-methyl-9-oxa-2-oxa-10-thia-5-azatricyclo[5.2.2.01,5]undecane-6-one
Thsaurus map：
Thesaurus Map

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