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SCU

概要
表記:N,N,N-TRIMETHYL-2-[(4-OXOBUTANOYL)OXY]ETHANAMINIUM
別名:SUCCINYLMONOCHOLINE
組成式:C9 H18 N O3
電荷:1
化学式量:188.244 Da
分子種別:NON-POLYMER

化合物名

プログラムバージョン表記
ACDLabs10.04N,N,N-trimethyl-2-[(4-oxobutanoyl)oxy]ethanaminium
OpenEye OEToolkits1.5.0trimethyl-[2-(4-oxobutanoyloxy)ethyl]azanium

化合物記述子(線形表記)

種別プログラムバージョン表記
SMILESACDLabs10.04O=CCCC(=O)OCC[N+](C)(C)C
SMILES_CANONICALCACTVS3.341C[N+](C)(C)CCOC(=O)CCC=O
SMILESCACTVS3.341C[N+](C)(C)CCOC(=O)CCC=O
SMILES_CANONICALOpenEye OEToolkits1.5.0C[N+](C)(C)CCOC(=O)CCC=O
SMILESOpenEye OEToolkits1.5.0C[N+](C)(C)CCOC(=O)CCC=O
InChIInChI1.03InChI=1S/C9H18NO3/c1-10(2,3)6-8-13-9(12)5-4-7-11/h7H,4-6,8H2,1-3H3/q+1
InChIKeyInChI1.03RIRQNBQBGSVENV-UHFFFAOYSA-N

222415

件を2024-07-10に公開中

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