Chem
J-GLOBAL ID：200907011402438020   Nikkaji number：J17.837C

Thermopsine

テルモプシン
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： C15H20N2O
Molecular formula furigana： C15-H20-N2-O
Molecular weight： 244.338
InChI： InChI=1S/C15H20N2O/c18-15-6-3-5-14-11-8-12(10-17(14)15)13-4-1-2-7-16(13)9-11/h3,5-6,11-13H,1-2,4,7-10H2/t11-,12-,13+/m1/s1
InChI key： FQEQMASDZFXSJI-UPJWGTAASA-N
SMILES： O=c1cccc2[C@@H]3C[C@H](Cn12)[C@@H]1CCCCN1C3
Systematic name  (3)：
  • (7R)-7,7aβ,8,9,10,11,13,14-オクタヒドロ-7β,14β-メタノ-4H,6H-ジピリド[1,2-a:1′,2′-e][1,5]ジアゾシン-4-オン
  • (1R,9R,10S)-7,15-ジアザテトラシクロ[7.7.1.02,7.010,15]ヘプタデカ-2,4-ジエン-6-オン
  • (1R,9R,10S)-7,15-diazatetracyclo[7.7.1.02,7.010,15]heptadeca-2,4-dien-6-one
Other name (3)：
  • テルモプシン
  • Thermopsine
  • (7R)-7,7aβ,8,9,10,11,13,14-Octahydro-7β,14β-methano-4H,6H-dipyrido[1,2-a:1′,2′-e][1,5]diazocin-4-one
CAS registry number： 486-90-8
KEGG COMPOUND： C10789
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