TWT

DOCOSANE

Created:	2002-05-24
Last modified:	2011-06-04

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7 entries where TWT is found as a standalone ligand

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

2D diagram of TWT

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Chemical Component Summary
Name	DOCOSANE
Systematic Name (OpenEye OEToolkits)	docosane
Formula	C₂₂ H₄₆
Molecular Weight	310.601
Type	NON-POLYMER

Chemical Descriptors
Type	Program	Version	Descriptor
SMILES	ACDLabs	10.04	C(CCCCCCCCCCCCCCCCCC)CCC
SMILES	CACTVS	3.341	CCCCCCCCCCCCCCCCCCCCCC
SMILES	OpenEye OEToolkits	1.5.0	CCCCCCCCCCCCCCCCCCCCCC
Canonical SMILES	CACTVS	3.341	CCCCCCCCCCCCCCCCCCCCCC
Canonical SMILES	OpenEye OEToolkits	1.5.0	CCCCCCCCCCCCCCCCCCCCCC
InChI	InChI	1.03	InChI=1S/C22H46/c1-3-5-7-9-11-13-15-17-19-21-22-20-18-16-14-12-10-8-6-4-2/h3-22H2,1-2H3
InChIKey	InChI	1.03	HOWGUJZVBDQJKV-UHFFFAOYSA-N

Related Resource References

Resource Name	Reference
PubChem	12405
ChEBI	CHEBI:46050

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