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SFU

概要
表記:methyl 1-seleno-alpha-L-fucopyranoside
別名:METHYL 6-DEOXY-1-SELENO-ALPHA-L-GALACTOPYRANOSIDE
methyl 1-seleno-alpha-L-fucoside; methyl 1-seleno-L-fucoside; methyl 1-seleno-fucoside
組成式:C7 H14 O4 Se
電荷:0
化学式量:241.144 Da
分子種別:L-saccharide

化合物名

プログラムバージョン表記
ACDLabs10.04methyl 6-deoxy-1-seleno-alpha-L-galactopyranoside
OpenEye OEToolkits1.6.1(2S,3S,4R,5S,6S)-2-methyl-6-methylselanyl-oxane-3,4,5-triol

化合物記述子(線形表記)

種別プログラムバージョン表記
SMILESACDLabs10.04OC1C(O)C(O)C(OC1[Se]C)C
SMILES_CANONICALCACTVS3.352C[Se][C@@H]1O[C@@H](C)[C@@H](O)[C@@H](O)[C@@H]1O
SMILESCACTVS3.352C[Se][CH]1O[CH](C)[CH](O)[CH](O)[CH]1O
SMILES_CANONICALOpenEye OEToolkits1.6.1C[C@H]1[C@H]([C@H]([C@@H]([C@@H](O1)[Se]C)O)O)O
SMILESOpenEye OEToolkits1.6.1CC1C(C(C(C(O1)[Se]C)O)O)O
InChIInChI1.03InChI=1S/C7H14O4Se/c1-3-4(8)5(9)6(10)7(11-3)12-2/h3-10H,1-2H3/t3-,4+,5+,6-,7-/m0/s1
InChIKeyInChI1.03VHTNTJQSKJZERS-XUVCUMPTSA-N

220113

件を2024-05-22に公開中

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