Chem
J-GLOBAL ID:200907049079444218   Nikkaji number:J2.320.169K

(13S)-13-(3-Methoxyphenyl)-12-oxa-15-thiatetracyclo[8.6.2.24,7.011,16]icosane-1(16),4,6,10,17,19-hexaene

(13S)-13-(3-メトキシフェニル)-12-オキサ-15-チアテトラシクロ[8.6.2.24,7.011,16]イコサ-1(16),4,6,10,17,19-ヘキサエン
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: C25H24O2S
Molecular formula furigana: C25-H24-O2-S
Molecular weight: 388.530
InChI: InChI=1S/C25H24O2S/c1-26-22-4-2-3-21(15-22)23-16-28-25-20-12-10-18-7-5-17(6-8-18)9-11-19(13-14-20)24(25)27-23/h2-8,13-15,23H,9-12,16H2,1H3/t23-/m1/s1
InChI key: ZRGBFQGKWGDMNR-HSZRJFAPSA-N
SMILES: COc1cccc(c1)[C@H]1CSc2c3CCc4ccc(CCc(cc3)c2O1)cc4
Systematic name  (3):
  • (13S)-13-(3-メトキシフェニル)-12-オキサ-15-チアテトラシクロ[8.6.2.24,7.011,16]イコサン-1(16),4,6,10,17,19-ヘキサエン
  • (13S)-13-(3-メトキシフェニル)-12-オキサ-15-チアテトラシクロ[8.6.2.24,7.011,16]イコサ-1(16),4,6,10,17,19-ヘキサエン
  • (13S)-13-(3-methoxyphenyl)-12-oxa-15-thiatetracyclo[8.6.2.24,7.011,16]icosa-1(16),4,6,10,17,19-hexaene
Other name (1):
  • (13S)-13-(3-Methoxyphenyl)-12-oxa-15-thiatetracyclo[8.6.2.24,7.011,16]icosane-1(16),4,6,10,17,19-hexaene
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