Chem
J-GLOBAL ID：200907087274961404   Nikkaji number：J1.700.109D

1-[(Z)-9-Tetradecenoyl]-3-(6-sulfo-α-D-glucopyranosyl)glycerol

1-[(Z)-9-テトラデセノイル]-3-(6-スルホ-α-D-グルコピラノシル)グリセロール
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： C23H42O12S
Molecular formula furigana： C23-H42-O12-S
Molecular weight： 542.640
InChI： InChI=1S/C23H42O12S/c1-2-3-4-5-6-7-8-9-10-11-12-13-14(24)15(25)16(26)18(28)21-19(29)17(27)20(30)22(35-21)23(31)36(32,33)34/h5-6,15-23,25-31H,2-4,7-13H2,1H3,(H,32,33,34)/b6-5-/t15?,16?,17-,18?,19-,20+,21-,22+,23?/m1/s1
InChI key： MVGMWLCZPQKPCL-GAIYOCMOSA-N
SMILES： CCCC/C=C\CCCCCCCC(=O)C(O)C(O)C(O)[C@H]1O[C@H](C(O)S(=O)(=O)O)[C@@H](O)[C@H](O)[C@H]1O
Systematic name  (3)：
  • 1-[(Z)-9-テトラデセノイル]-3-(6-スルホ-α-D-グルコピラノシル)グリセロール
  • ヒドロキシ[(2S,3S,4R,5R,6S)-3,4,5-トリヒドロキシ-6-[(12Z)-1,2,3-トリヒドロキシ-4-オキソヘプタデカ-12-エン-1-イル]オキサン-2-イル]メタンスルホン酸
  • hydroxy[(2S,3S,4R,5R,6S)-3,4,5-trihydroxy-6-[(12Z)-1,2,3-trihydroxy-4-oxoheptadec-12-en-1-yl]oxan-2-yl]methanesulfonic acid
Other name (1)：
  • 1-[(Z)-9-Tetradecenoyl]-3-(6-sulfo-α-D-glucopyranosyl)glycerol
Thsaurus map：
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