Chem
J-GLOBAL ID:200907019671126966   Nikkaji number:J2.344.972B

1-O-Octadecanoyl-2-O-icosanoylglycerol 3-phosphoric acid 6-O-acetyl-β-D-glucopyranosyl ester

1-O-オクタデカノイル-2-O-イコサノイルグリセロール3-りん酸6-O-アセチル-β-D-グルコピラノシル
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: C49H93O14P
Molecular formula furigana: C49-H93-O14-P
Molecular weight: 937.243
InChI: InChI=1S/C49H93O14P/c1-4-6-8-10-12-14-16-18-20-21-23-25-27-29-31-33-35-37-45(52)61-42(38-59-44(51)36-34-32-30-28-26-24-22-19-17-15-13-11-9-7-5-2)39-60-64(56,57)63-49-48(55)47(54)46(53)43(62-49)40-58-41(3)50/h42-43,46-49,53-55H,4-40H2,1-3H3,(H,56,57)/t42?,43-,46-,47+,48-,49+/m1/s1
InChI key: DSHVCPCRTVONJU-PYBXMOCKSA-N
SMILES: CCCCCCCCCCCCCCCCCCCC(=O)OC(COC(=O)CCCCCCCCCCCCCCCCC)COP(=O)(O)O[C@@H]1O[C@H](COC(=O)C)[C@@H](O)[C@H](O)[C@H]1O
Systematic name  (4):
  • [2-[(1-オキソイコシル)オキシ]-3-[(1-オキソオクタデシル)オキシ]プロポキシ]ヒドロキシホスフィニル6-O-アセチル-β-D-グルコピラノシド
  • 1-O-オクタデカノイル-2-O-イコサノイルグリセロール3-りん酸6-O-アセチル-β-D-グルコピラノシル
  • {[(2S,3R,4S,5S,6R)-6-[(アセチルオキシ)メチル]-3,4,5-トリヒドロキシオキサン-2-イル]オキシ}[2-(イコサノイルオキシ)-3-(オクタデカノイルオキシ)プロポキシ]ホスフィン酸
  • {[(2S,3R,4S,5S,6R)-6-[(acetyloxy)methyl]-3,4,5-trihydroxyoxan-2-yl]oxy}[2-(icosanoyloxy)-3-(octadecanoyloxy)propoxy]phosphinic acid
Other name (2):
  • [2-[(1-Oxoicosyl)oxy]-3-[(1-oxooctadecyl)oxy]propoxy]hydroxyphosphinyl 6-O-acetyl-β-D-glucopyranoside
  • 1-O-Octadecanoyl-2-O-icosanoylglycerol 3-phosphoric acid 6-O-acetyl-β-D-glucopyranosyl ester
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