DSL

MONO-TRANS, OCTA-CIS DECAPRENYL-PHOSPHATE

Created:	2010-11-11
Last modified:	2011-06-04

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4 entries where DSL is found as a standalone ligand

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Chemical Details
Formal Charge	0
Atom Count	138
Chiral Atom Count	0
Bond Count	137
Aromatic Bond Count	0

2D diagram of DSL

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Chemical Component Summary
Name	MONO-TRANS, OCTA-CIS DECAPRENYL-PHOSPHATE
Systematic Name (OpenEye OEToolkits)	[(2Z,6Z,10Z,14Z,18Z,22Z,26Z,30Z,34E)-3,7,11,15,19,23,27,31,35,39-decamethyltetraconta-2,6,10,14,18,22,26,30,34,38-decaenyl] dihydrogen phosphate
Formula	C₅₀ H₈₃ O₄ P
Molecular Weight	779.165
Type	NON-POLYMER

Chemical Descriptors
Type	Program	Version	Descriptor
SMILES	CACTVS	3.352	CC(C)=CCCC(C)=CCCC(C)=CCCC(C)=CCCC(C)=CCCC(C)=CCCC(C)=CCCC(C)=CCCC(C)=CCCC(C)=CCO[P](O)(O)=O
SMILES	OpenEye OEToolkits	1.6.1	CC(=CCCC(=CCCC(=CCCC(=CCCC(=CCCC(=CCCC(=CCCC(=CCCC(=CCCC(=CCOP(=O)(O)O)C)C)C)C)C)C)C)C)C)C
Canonical SMILES	CACTVS	3.352	CC(C)=CCC\C(C)=C\CC\C(C)=C/CC\C(C)=C/CC\C(C)=C/CC\C(C)=C/CC\C(C)=C/CC\C(C)=C/CC\C(C)=C/CC\C(C)=C/CO[P](O)(O)=O
Canonical SMILES	OpenEye OEToolkits	1.6.1	CC(=CCC/C(=C/CC/C(=C\CC/C(=C\CC/C(=C\CC/C(=C\CC/C(=C\CC/C(=C\CC/C(=C\CC/C(=C\COP(=O)(O)O)/C)/C)/C)/C)/C)/C)/C)/C)/C)C
InChI	InChI	1.03	InChI=1S/C50H83O4P/c1-41(2)21-12-22-42(3)23-13-24-43(4)25-14-26-44(5)27-15-28-45(6)29-16-30-46(7)31-17-32-47(8)33-18-34-48(9)35-19-36-49(10)37-20-38-50(11)39-40-54-55(51,52)53/h21,23,25,27,29,31,33,35,37,39H,12-20,22,24,26,28,30,32,34,36,38,40H2,1-11H3,(H2,51,52,53)/b42-23+,43-25-,44-27-,45-29-,46-31-,47-33-,48-35-,49-37-,50-39-
InChIKey	InChI	1.03	XBEJBEIXLWRYBT-DJNGBRKISA-N

Related Resource References

Resource Name	Reference
PubChem	45479680
ChEBI	CHEBI:66867

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