Structure database (LMSD)Return to Databases Overview
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LM ID | LMGP03020005 | |||||||||||||||||||||||||||
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Common Name | PS(O-16:0/15:0) | |||||||||||||||||||||||||||
Systematic Name | 1-hexadecyl-2-pentadecanoyl-glycero-3-phosphoserine | |||||||||||||||||||||||||||
Synonyms | PS(O-31:0); PS(O-16:0/15:0) | |||||||||||||||||||||||||||
Exact Mass | ||||||||||||||||||||||||||||
Formula | C37H74NO9P | |||||||||||||||||||||||||||
Category | Glycerophospholipids [GP] | |||||||||||||||||||||||||||
Main Class | Glycerophosphoserines [GP03] | |||||||||||||||||||||||||||
Sub Class | 1-alkyl,2-acylglycerophosphoserines [GP0302] | |||||||||||||||||||||||||||
Abbrev | PS O-31:0 | |||||||||||||||||||||||||||
Abbrev Chains | PS O-16:0/15:0 | |||||||||||||||||||||||||||
PubChem CID | 52926094 | |||||||||||||||||||||||||||
SWISSLIPIDS ID | SLM:000044845 | |||||||||||||||||||||||||||
InChIKey | OHIPNGBMAJNIFN-GPOMZPHUSA-N Show lipids differing only in stereochemistry/bond geometry | |||||||||||||||||||||||||||
InChI |
InChI=1S/C37H74NO9P/c1-3-5-7-9-11-13-15-17-18-20-22-24-26-28-30-44-31-34(32-45-48(42,43)46-33-35(38)37(40)41)47-36(39)29-27-25-23-21-19-16-14-12-10-8-6-4-2/h34-35H,3-33,38H2,1-2H3,(H,40,41)(H,42,43)/t34-,35+/m1/s1
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SMILES |
C(O)(=O)[C@@]([H])(N)COP(OC[C@]([H])(OC(CCCCCCCCCCCCCC)=O)COCCCCCCCCCCCCCCCC)(=O)O
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Status | Active (generated by computational methods) | |||||||||||||||||||||||||||
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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. |