Chem
J-GLOBAL ID:201207053158157839   Nikkaji number:J3.088.332B

(2S)-2-[(1R,9S,11S)-5-Methoxy-12-oxatricyclo[7.2.1.02,7]dodeca-2(7),3,5-triene-11-yl]-2-(tosylamino)acetic acid ethyl ester

(2S)-2-[(1R,9S,11S)-5-メトキシ-12-オキサトリシクロ[7.2.1.02,7]ドデカ-2(7),3,5-トリエン-11-イル]-2-(トシルアミノ)酢酸エチル
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: C23H27NO6S
Molecular formula furigana: C23-H27-N-O6-S
Molecular weight: 445.530
InChI: InChI=1S/C23H27NO6S/c1-4-29-23(25)21(24-31(26,27)18-8-5-14(2)6-9-18)20-13-17-12-15-11-16(28-3)7-10-19(15)22(20)30-17/h5-11,17,20-22,24H,4,12-13H2,1-3H3/t17-,20+,21+,22+/m1/s1
InChI key: JSMUNVAFGTZXRR-MNAPGUCWSA-N
SMILES: CCOC(=O)[C@@H](NS(=O)(=O)c1ccc(C)cc1)[C@@H]1C[C@H]2Cc3cc(OC)ccc3[C@@H]1O2
Systematic name  (3):
  • (2S)-2-[(1R,9S,11S)-5-メトキシ-12-オキサトリシクロ[7.2.1.02,7]ドデカ-2(7),3,5-トリエン-11-イル]-2-(トシルアミノ)酢酸エチル
  • エチル (2S)-2-[(1R,9S,11S)-5-メトキシ-12-オキサトリシクロ[7.2.1.02,7]ドデカ-2,4,6-トリエン-11-イル]-2-(4-メチルベンゼンスルホンアミド)アセタート
  • ethyl (2S)-2-[(1R,9S,11S)-5-methoxy-12-oxatricyclo[7.2.1.02,7]dodeca-2,4,6-trien-11-yl]-2-(4-methylbenzenesulfonamido)acetate
Other name (1):
  • (2S)-2-[(1R,9S,11S)-5-Methoxy-12-oxatricyclo[7.2.1.02,7]dodeca-2(7),3,5-triene-11-yl]-2-(tosylamino)acetic acid ethyl ester
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