Chem
J-GLOBAL ID：200907088762096409   Nikkaji number：J1.700.110H

1-Oleoyl-3-(6-sulfo-α-D-glucopyranosyl)glycerol

1-オレオイル-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： C27H50O12S
Molecular formula furigana： C27-H50-O12-S
Molecular weight： 598.750
InChI： InChI=1S/C27H50O12S/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18(28)19(29)20(30)22(32)25-23(33)21(31)24(34)26(39-25)27(35)40(36,37)38/h9-10,19-27,29-35H,2-8,11-17H2,1H3,(H,36,37,38)/b10-9-/t19?,20?,21-,22?,23-,24+,25-,26+,27?/m1/s1
InChI key： PDNBFCLGAPOLRC-IFALPNHKSA-N
SMILES： CCCCCCCC/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-オレオイル-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-オキソヘンイコサ-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-oxohenicos-12-en-1-yl]oxan-2-yl]methanesulfonic acid
Other name (1)：
  • 1-Oleoyl-3-(6-sulfo-α-D-glucopyranosyl)glycerol
Thsaurus map：
Thesaurus Map

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