PLC

DIUNDECYL PHOSPHATIDYL CHOLINE

Created:	1999-07-08
Last modified:	2011-06-04

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118 entries where PLC is found as a standalone ligand

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Chemical Details
Formal Charge	1
Atom Count	107
Chiral Atom Count	2
Bond Count	106
Aromatic Bond Count	0

2D diagram of PLC

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Chemical Component Summary
Name	DIUNDECYL PHOSPHATIDYL CHOLINE
Systematic Name (OpenEye OEToolkits)	2-[[(2R)-2,3-di(dodecanoyloxy)propoxy]-hydroxy-phosphoryl]oxyethyl-trimethyl-azanium
Formula	C₃₂ H₆₅ N O₈ P
Molecular Weight	622.834
Type	NON-POLYMER

Chemical Descriptors
Type	Program	Version	Descriptor
SMILES	ACDLabs	10.04	O=C(OCC(OC(=O)CCCCCCCCCCC)COP(=O)(OCC[N+](C)(C)C)O)CCCCCCCCCCC
SMILES	CACTVS	3.341	CCCCCCCCCCCC(=O)OC[CH](CO[P](O)(=O)OCC[N+](C)(C)C)OC(=O)CCCCCCCCCCC
SMILES	OpenEye OEToolkits	1.5.0	CCCCCCCCCCCC(=O)OCC(COP(=O)(O)OCC[N+](C)(C)C)OC(=O)CCCCCCCCCCC
Canonical SMILES	CACTVS	3.341	CCCCCCCCCCCC(=O)OC[C@H](CO[P@@](O)(=O)OCC[N+](C)(C)C)OC(=O)CCCCCCCCCCC
Canonical SMILES	OpenEye OEToolkits	1.5.0	CCCCCCCCCCCC(=O)OC[C@H](CO[P@](=O)(O)OCC[N+](C)(C)C)OC(=O)CCCCCCCCCCC
InChI	InChI	1.03	InChI=1S/C32H64NO8P/c1-6-8-10-12-14-16-18-20-22-24-31(34)38-28-30(29-40-42(36,37)39-27-26-33(3,4)5)41-32(35)25-23-21-19-17-15-13-11-9-7-2/h30H,6-29H2,1-5H3/p+1/t30-/m1/s1
InChIKey	InChI	1.03	IJFVSSZAOYLHEE-SSEXGKCCSA-O

Drug Info: DrugBank

DrugBank ID	DB02777
Name	Diundecyl Phosphatidyl Choline
Groups	experimental
Synonyms	Diundecyl Phosphatidyl Choline

Related Resource References

Resource Name	Reference
PubChem	445355
ChEBI	CHEBI:60273

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