Chem
J-GLOBAL ID:200907089560877626
Nikkaji number:J612.383J
N-[(1S,2R,3E)-1-[(Phosphonooxy)methyl]-2-hydroxy-3-heptadecenyl]octanamide
{[(2S,3R,4E)-3-ヒドロキシ-2-オクタンアミドオクタデカ-4-エン-1-イル]オキシ}ホスホン酸
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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:
C26 H52 NO6 P
Molecular formula furigana:
C26-H52-N-O6-P
Molecular weight:
505.677
InChI:
InChI=1S/C26H52NO6P/c1-3-5-7-9-10-11-12-13-14-15-16-18-19-21-25(28)24(23-33-34(30,31)32)27-26(29)22-20-17-8-6-4-2/h19,21,24-25,28H,3-18,20,22-23H2,1-2H3,(H,27,29)(H2,30,31,32)/b21-19+/t24-,25+/m0/s1
InChI key:
VSSNYUXSRXINIP-WRBRXSDHSA-N
SMILES:
CCCCCCCCCCCCC/C=C/[C@@H](O)[C@H](COP(=O)(O)O)NC(=O)CCCCCCC
Systematic name (3):
N-[(1S,2R,3E)-1-[(ホスホノオキシ)メチル]-2-ヒドロキシ-3-ヘプタデセニル]オクタンアミド
{[(2S,3R,4E)-3-ヒドロキシ-2-オクタンアミドオクタデカ-4-エン-1-イル]オキシ}ホスホン酸
{[(2S,3R,4E)-3-hydroxy-2-octanamidooctadec-4-en-1-yl]oxy}phosphonic acid
Other name (1):
N-[(1S,2R,3E)-1-[(Phosphonooxy)methyl]-2-hydroxy-3-heptadecenyl]octanamide
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