Chem
J-GLOBAL ID：200907079393698182   Nikkaji number：J508.468G

(3R,4aβ,8aα)-6-[(1H-Tetrazol-5-yl)methyl]decahydroisoquinoline-3β-carboxylic acid

(3R,4aβ,8aα)-6-[(1H-テトラゾール-5-イル)メチル]デカヒドロイソキノリン-3β-カルボン酸
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： C12H19N5O2
Molecular formula furigana： C12-H19-N5-O2
Molecular weight： 265.317
InChI： InChI=1S/C12H19N5O2/c18-12(19)10-5-9-3-7(1-2-8(9)6-13-10)4-11-14-16-17-15-11/h7-10,13H,1-6H2,(H,18,19)(H,14,15,16,17)/t7?,8-,9-,10+/m0/s1
InChI key： ACTONBBIVMTUAJ-JVSARINNSA-N
SMILES： OC(=O)[C@H]1C[C@@H]2CC(Cc3nnn[nH]3)CC[C@H]2CN1
Systematic name  (3)：
  • (3R,4aβ,8aα)-6-[(1H-テトラゾール-5-イル)メチル]デカヒドロイソキノリン-3β-カルボン酸
  • (3R,4aS,8aR)-6-[(1H-1,2,3,4-テトラゾール-5-イル)メチル]-デカヒドロイソキノリン-3-カルボン酸
  • (3R,4aS,8aR)-6-[(1H-1,2,3,4-tetrazol-5-yl)methyl]-decahydroisoquinoline-3-carboxylic acid
Other name (1)：
  • (3R,4aβ,8aα)-6-[(1H-Tetrazol-5-yl)methyl]decahydroisoquinoline-3β-carboxylic acid
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