7HW

(4Z,7Z,10Z,13Z,16Z,19R,20R)-19,20-dihydroxydocosa-4,7,10,13,16-pentaenoic acid

Created:	2016-10-30
Last modified:	2024-09-27

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1 entries where 7HW is covalently linked to polymer or other heterogen groups

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Chemical Details
Formal Charge	0
Atom Count	60
Chiral Atom Count	2
Bond Count	59
Aromatic Bond Count	0

2D diagram of 7HW

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Chemical Component Summary
Name	(4Z,7Z,10Z,13Z,16Z,19R,20R)-19,20-dihydroxydocosa-4,7,10,13,16-pentaenoic acid
Systematic Name (OpenEye OEToolkits)	(4~{Z},10~{Z},13~{Z},16~{Z},19~{R},20~{R})-19,20-bis(oxidanyl)docosa-4,7,10,13,16-pentaenoic acid
Formula	C₂₂ H₃₄ O₄
Molecular Weight	362.503
Type	NON-POLYMER

Chemical Descriptors
Type	Program	Version	Descriptor
SMILES	ACDLabs	12.01	CCC(C(O)C[C@H]=CC/C=C\C[C@H]=[C@H]C[C@H]=[C@H]C[C@H]=CCCC(=O)O)O
SMILES	CACTVS	3.385	CC[CH](O)[CH](O)CC=CCC=CCC=CCC=CCC=CCCC(O)=O
SMILES	OpenEye OEToolkits	2.0.6	CCC(C(CC=CCC=CCC=CCC=CCC=CCCC(=O)O)O)O
Canonical SMILES	CACTVS	3.385	CC[C@@H](O)[C@H](O)C\C=C/C/C=C\C\C=C/C\C=C/C\C=C/CCC(O)=O
Canonical SMILES	OpenEye OEToolkits	2.0.6	CC[C@H]([C@@H](C/C=C\C/C=C\C/C=C\CC=CC/C=C\CCC(=O)O)O)O
InChI	InChI	1.03	InChI=1S/C22H34O4/c1-2-20(23)21(24)18-16-14-12-10-8-6-4-3-5-7-9-11-13-15-17-19-22(25)26/h3-4,7-10,13-16,20-21,23-24H,2,5-6,11-12,17-19H2,1H3,(H,25,26)/b4-3-,9-7?,10-8-,15-13-,16-14-/t20-,21-/m1/s1
InChIKey	InChI	1.03	FFXKPSNQCPNORO-KVZKRMIJSA-N

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