Structure database (LMSD)Return to Databases Overview
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| LM ID | LMGP21030002 | |||||||||||||||||||||||||||
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| Common Name | Am-PE(P-20:0/18:2(9Z,12Z)) | |||||||||||||||||||||||||||
| Systematic Name | N-(1-deoxyfructosyl)-1-(1Z-eicosenyl)-2-(9Z,12Z-octadecadienoyl)-glycero-3- phosphoethanolamine | |||||||||||||||||||||||||||
| Synonyms | Amadori-PE P-20:0/18:2 | |||||||||||||||||||||||||||
| Exact Mass | ||||||||||||||||||||||||||||
| Formula | C49H92NO12P | |||||||||||||||||||||||||||
| Category | Glycerophospholipids [GP] | |||||||||||||||||||||||||||
| Main Class | Glycerophosphoethanolamine glycans [GP21] | |||||||||||||||||||||||||||
| Sub Class | 1-(1Z-alkenyl),2-acylglycerophosphoethanolamine glycans [GP2103] | |||||||||||||||||||||||||||
| Abbrev | Am-Hex-PE O-38:3 | |||||||||||||||||||||||||||
| Abbrev Chains | Am-Hex-PE P-20:0/18:2 | |||||||||||||||||||||||||||
| PubChem CID | - | |||||||||||||||||||||||||||
| InChIKey | JBSIYQTWAMHTOW-OCAWJHQXSA-N Show lipids differing only in stereochemistry/bond geometry | |||||||||||||||||||||||||||
| InChI |
InChI=1S/C49H92NO12P/c1-3-5-7-9-11-13-15-17-19-20-21-23-25-27-29-31-33-35-38-58-40-44(62-46(52)36-34-32-30-28-26-24-22-18-16-14-12-10-8-6-4-2)41-61-63(56,57)60-39-37-50-43-49(55)48(54)47(53)45(51)42-59-49/h12,14,18,22,35,38,44-45,47-48,50-51,53-55H,3-11,13,15-17,19-21,23-34,36-37,39-43H2,1-2H3,(H,56,57)/b14-12-,22-18-,38-35-/t44-,45-,47-,48+,49-/m1/s1
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| SMILES |
N(CCOP(OC[C@]([H])(OC(CCCCCCC/C=C\C/C=C\CCCCC)=O)CO/C=C\CCCCCCCCCCCCCCCCCC)(=O)O)C[C@]1(O)[C@@H](O)[C@H](O)[C@H](O)CO1
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| Status | Active | |||||||||||||||||||||||||||
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LIPID MAPS® abbreviations for glycerophospholipids (GP) The LIPID MAPS® glycerophospholipid abbreviations (PC, PE, etc.) are used here to refer to species with one or two radyl side-chains where the structures of the side chains are indicated within parentheses in the 'Headgroup(sn1/sn2)' format (e.g. PC(16:0/18:1(9Z)). By default, R stereochemistry at the C-2 carbon of glycerol and attachment of the headgroup at the sn3 position is assumed. Also, acyl chains are assumed by default. The 'O-' prefix is used to indicate the presence of an alkyl ether substituent e.g. PC(O-16:0/18:1(9Z)), whereas the 'P-' prefix is used for the 1Z-alkenyl ether (Plasmalogen) substituent e.g. PC(P-16:0/18:1(9Z)). For molecules with opposite (S) stereochemistry at C2 of the glycerol group and attachment of the headgroup at the sn1 position, the stereochemistry specification of [S] is appended to the abbreviation. The 'Headgroup(sn3/sn2)' abbreviation format is used. For molecules with unknown stereochemistry at the C-2 carbon of the glycerol group, the stereochemistry specification of [U] is appended to the abbreviation and the structure is drawn with C-2 stereochemistry unspecified. |
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