18L

(2R)-2-hydroxy-3-(phosphonooxy)propyl (9Z,12Z)-octadeca-9,12-dienoate

Created:	2011-01-26
Last modified:	2020-06-05

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1 entries where 18L is found as a standalone ligand

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Chemical Details
Formal Charge	0
Atom Count	68
Chiral Atom Count	1
Bond Count	67
Aromatic Bond Count	0

2D diagram of 18L

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Chemical Component Summary
Name	(2R)-2-hydroxy-3-(phosphonooxy)propyl (9Z,12Z)-octadeca-9,12-dienoate
Synonyms	D (+)-sn-1-O-linoleoyl-glyceryl-3-phosphate
Systematic Name (OpenEye OEToolkits)	[(2R)-2-hydroxy-3-phosphonooxy-propyl] (9Z,12Z)-octadeca-9,12-dienoate
Formula	C₂₁ H₃₉ O₇ P
Molecular Weight	434.504
Type	NON-POLYMER

Chemical Descriptors
Type	Program	Version	Descriptor
SMILES	ACDLabs	12.01	O=P(OCC(O)COC(=O)CCCCCCC\C=C/C\C=C/CCCCC)(O)O
SMILES	CACTVS	3.370	CCCCCC=CCC=CCCCCCCCC(=O)OC[CH](O)CO[P](O)(O)=O
SMILES	OpenEye OEToolkits	1.7.0	CCCCCC=CCC=CCCCCCCCC(=O)OCC(COP(=O)(O)O)O
Canonical SMILES	CACTVS	3.370	CCCCC\C=C/C\C=C/CCCCCCCC(=O)OC[C@@H](O)CO[P](O)(O)=O
Canonical SMILES	OpenEye OEToolkits	1.7.0	CCCCC/C=C\C/C=C\CCCCCCCC(=O)OC[C@H](COP(=O)(O)O)O
InChI	InChI	1.03	InChI=1S/C21H39O7P/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-21(23)27-18-20(22)19-28-29(24,25)26/h6-7,9-10,20,22H,2-5,8,11-19H2,1H3,(H2,24,25,26)/b7-6-,10-9-/t20-/m1/s1
InChIKey	InChI	1.03	ZQTAMPRZFOOEEP-KKFOGOCZSA-N

Related Resource References

Resource Name	Reference
PubChem	50990923
ChEBI	CHEBI:62834

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