Chem
J-GLOBAL ID：201007023105509295   Nikkaji number：J2.787.078C

1-Hexadecanoyl-2-(9Z-octadecenoyl)-sn-glycero-3-phospho-1′-myo-inositol

1-O-[1-O-ヘキサデカノイル-2-O-[(9Z)-1-オキソ-9-オクタデセニル]-L-グリセロ-3-ホスホ]-D-myo-イノシトール
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： C43H81O13P
Molecular formula furigana： C43-H81-O13-P
Molecular weight： 837.082
InChI： InChI=1S/C43H81O13P/c1-3-5-7-9-11-13-15-17-18-20-22-24-26-28-30-32-37(45)55-35(34-54-57(51,52)56-43-41(49)39(47)38(46)40(48)42(43)50)33-53-36(44)31-29-27-25-23-21-19-16-14-12-10-8-6-4-2/h17-18,35,38-43,46-50H,3-16,19-34H2,1-2H3,(H,51,52)/b18-17-/t35-,38-,39-,40+,41-,42-,43?/m1/s1
InChI key： PDLAMJKMOKWLAJ-JRDQLPAKSA-N
SMILES： CCCCCCCCCCCCCCCC(=O)OC[C@H](COP(=O)(O)OC1[C@H](O)[C@@H](O)[C@H](O)[C@@H](O)[C@H]1O)OC(=O)CCCCCCC/C=C\CCCCCCCC
Systematic name  (3)：
  • 1-O-[1-O-ヘキサデカノイル-2-O-[(9Z)-1-オキソ-9-オクタデセニル]-L-グリセロ-3-ホスホ]-D-myo-イノシトール
  • [(2R)-3-(ヘキサデカノイルオキシ)-2-[(9Z)-オクタデカ-9-エノイルオキシ]プロポキシ]({[(2R,3R,4S,5S,6R)-2,3,4,5,6-ペンタヒドロキシシクロヘキシル]オキシ})ホスフィン酸
  • [(2R)-3-(hexadecanoyloxy)-2-[(9Z)-octadec-9-enoyloxy]propoxy]({[(2R,3R,4S,5S,6R)-2,3,4,5,6-pentahydroxycyclohexyl]oxy})phosphinic acid
Other name (2)：
  • 1-O-[1-O-Hexadecanoyl-2-O-[(9Z)-1-oxo-9-octadecenyl]-L-glycero-3-phospho]-D-myo-inositol
  • 1-Hexadecanoyl-2-(9Z-octadecenoyl)-sn-glycero-3-phospho-1′-myo-inositol
KEGG COMPOUND： C13888
Thsaurus map：
Thesaurus Map

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