Structure database (LMSD)

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LM IDLMGP15010009
Common NamePIM1(17:0/16:0)
Systematic Name2'-O-(α-D-Manp)-(1-heptadecanoyl-2-hexadecanoyl-sn-glycero-3-phospho-1'-myo-
SynonymsPIM1(33:0); PIM1(16:0_17:0)
Exact Mass
986.5943 (neutral)    Calculate m/z:
CategoryGlycerophospholipids [GP]
Main ClassGlycerophosphoinositolglycans [GP15]
Sub ClassDiacylglycerophosphoinositolglycans [GP1501]
AbbrevPIM1 33:0
Abbrev ChainsPIM1 16:0_17:0
PubChem CID126457377
InChIKeyHLGNFQXTFBHEBW-YYBSKHLHSA-N  Show lipids differing only in stereochemistry/bond geometry
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StatusActive (generated by computational methods)
SpeciesMycobacterium tuberculosis
Calculated physicochemical properties (?):
 Heavy Atoms67Rings2Aromatic Rings0Rotatable Bonds42
 van der Waals
Molecular Volume
987.01Topological Polar
Surface Area
Bond Donors
Bond Acceptors
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.