Pentadecatrienoate

ScientificNameLabel

Pentadecatrienoate
PHCD compound ID :	2087
Chemical Names :	Pentadecatrienoate
Molecular Formula :	C16H26O2
Molecular Weight :	250.19328

More Details :

Names & Synonyms:	methyl (5Z,7E,9Z)-pentadeca-5,7,9-trienoate , (5Z,7E,9Z)-pentadeca-5,7,9-trienoic acid methyl ester
Smiles:	CCCCC/C=C\C=C\C=C/CCCC(=O)OC
InChi :	InChI=1S/C16H26O2/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16(17)18-2/h7-12H,3-6,13-15H2,1-2H3/b8-7-,10-9+,12-11-
InChi Key :	InChIKey=JLGXILNLDHKGHF-WTQDWYTRSA-N
PubChem ID :	14921641

Rotatable bond count :	11	Rule of five :	2
Hydrogen bond acceptor count :	2	Ionization potential :	8.673330
Hydrogen bond donor count :	0	Electric dipole moment :	1.449
XLogP :	5.918	VDW volume :	292.326831
Molecular weight :	250.19328	HOMO-LUMO gap :	8.709000

Herb list :

Tamarind, Indian date - Tamarindus indica - تمرهندی

Refrences & Litretures:


249. Journal:'Pak. J. Bot' Year:'2008' Volume:'40' Page:'2553' DOI:'' Title:'CHEMICAL CONSTITUENTS OF TAMARINDUS INDICA L. MEDICINAL PLANT IN SINDH'

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