Name: 3D-Monophosphoryl Lipid (14)
Rating: 5 (10 reviews)

有库存

sdf 文件

结构编辑

类似物检索

HIT ID:HIT219586605
Cas No:252042-59-4
常用名:3D-Monophosphoryl Lipid (14)
别名:3D-MPL (14), 3D-Monophosphoryl Lipid (14)
别名:3D-MPL (14), 3D-Monophosphoryl Lipid (14)
IUPAC:{[(2R,3S,4R,5R,6R)-2-(hydroxymethyl)-5-[(3R)-3-(tetradecanoyloxy)tetradecanamido]-4-{[(3R)-3-(tetradecanoyloxy)tetradecanoyl]oxy}-6-{[(2R,3S,4R,5R)-2,3,4-trihydroxy-6-oxo-5-[(3R)-3-(tetradecanoyloxy)tetradecanamido]hexyl]oxy}oxan-3-yl]oxy}phosphonic acid
IUPAC:{[(2R,3S,4R,5R,6R)-2-(hydroxymethyl)-5-[(3R)-3-(tetradecanoyloxy)tetradecanamido]-4-{[(3R)-3-(tetradecanoyloxy)tetradecanoyl]oxy}-6-{[(2R,3S,4R,5R)-2,3,4-trihydroxy-6-oxo-5-[(3R)-3-(tetradecanoyloxy)tetradecanamido]hexyl]oxy}oxan-3-yl]oxy}phosphonic acid
InChI key:UWZZPPFXKHHIMQ-QXFLKPNTSA-N

分子式:C96H181N2O21P
分子量:1730.471
氢键供体数 (HBD):
氢键受体数 (HBA):
LogP:
SMILES:CCCCCCCCCCCCCC(=O)O[C@H](CCCCCCCCCCC)CC(=O)N[C@@H](C=O)[C@@H](O)[C@H](O)[C@H](O)CO[C@@H]1O[C@H](CO)[C@@H](OP(O)(O)=O)[C@H](OC(=O)C[C@@H](CCCCCCCCCCC)OC(=O)CCCCCCCCCCCCC)[C@H]1NC(=O)C[C@@H](CCCCCCCCCCC)OC(=O)CCCCCCCCCCCCC
SMILES:CCCCCCCCCCCCCC(=O)O[C@H](CCCCCCCCCCC)CC(=O)N[C@@H](C=O)[C@@H](O)[C@H](O)[C@H](O)CO[C@@H]1O[C@H](CO)[C@@H](OP(O)(O)=O)[C@H](OC(=O)C[C@@H](CCCCCCCCCCC)OC(=O)CCCCCCCCCCCCC)[C@H]1NC(=O)C[C@@H](CCCCCCCCCCC)OC(=O)CCCCCCCCCCCCC

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