Chem
J-GLOBAL ID:200907082569940482
Nikkaji number:J1.083.555K
(3S,4R)-3-Hydroxy-4-(hydroxymethyl)-7-(benzyloxy)heptanenitrile
(3S,4R)-3-ヒドロキシ-4-(ヒドロキシメチル)-7-(ベンジルオキシ)ヘプタンニトリル
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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:
C15 H21 NO3
Molecular formula furigana:
C15-H21-N-O3
Molecular weight:
263.337
InChI:
InChI=1S/C15H21NO3/c16-9-8-15(18)14(11-17)7-4-10-19-12-13-5-2-1-3-6-13/h1-3,5-6,14-15,17-18H,4,7-8,10-12H2/t14-,15+/m1/s1
InChI key:
QZMLOAPQAMXTTL-CABCVRRESA-N
SMILES:
OC[C@@H](CCCOCc1ccccc1)[C@@H](O)CC#N
Systematic name (3):
(3S,4R)-3-ヒドロキシ-4-(ヒドロキシメチル)-7-(ベンジルオキシ)ヘプタンニトリル
(3S,4R)-7-(ベンジルオキシ)-3-ヒドロキシ-4-(ヒドロキシメチル)ヘプタンニトリル
(3S,4R)-7-(benzyloxy)-3-hydroxy-4-(hydroxymethyl)heptanenitrile
Other name (1):
(3S,4R)-3-Hydroxy-4-(hydroxymethyl)-7-(benzyloxy)heptanenitrile
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