MetaNetX
Automated Model Construction and Genome Annotation for Large-Scale Metabolic Networks

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bombykol

	Properties	Image
MNX_ID	MNXM44556
reference	chebi:41200
formula	C₁₆H₃₀O
global charge	0
mol weight	238.415
InChIKey	CIVIWCVVOFNUST-SCFJQAPRSA-N
InChI	InChI=1S/C16H30O/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17/h4-7,17H,2-3,8-16H2,1H3/b5-4-,7-6+
SMILES	CCC/C=C\C=C\CCCCCCCCCO

MNX internals

InChI (mnx)	InChI=1/C16H30O/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17/h4-7,17H,2-3,8-16H2,1H3/b5-4-,7-6+
SMILES (mnx)	[CH3:1][CH2:2][CH2:3]/[CH:4]=[CH:5]\[CH:6]=[CH:7]\[CH2:8][CH2:9][CH2:10][CH2:11][CH2:12][CH2:13][CH2:14][CH2:15][CH2:16][OH:17]

Parent-child relations graph

Occurences in reactions	#reac
in my sandbox	0
in MNXref (generic)	1
in models (compartimentalized)	0

Similar chemical compounds in external resources
Identifier	Description
CHEBI:41200 chebi:41200 CIVIWCVVOFNUST-SCFJQAPRSA-N	bombykol (10E,12Z)-hexadeca-10,12-dien-1-ol (Z,E)-10,12-Hexadecadien-1-ol 10E,12Z-hexadecadien-1-ol Isobombycol hexadeca-10E,12Z-dien-1-ol
kegg.compound:C16873 keggC:C16873 CIVIWCVVOFNUST-SCFJQAPRSA-N	Bombykol (10E,12Z)-Hexadeca-10,12-dien-1-ol (Z,E)-10,12-Hexadecadien-1-ol
seed.compound:cpd17169 seedM:cpd17169 CIVIWCVVOFNUST-SCFJQAPRSA-N	Bombykol (E,Z)-10,12-hexadecadien-1-ol 10E,12Z-hexadecadien-1-ol 765-17-3 bombykol hexadeca-10E,12Z-dien-1-ol isobombycol
lipidmaps:LMFA05000007 lipidmapsM:LMFA05000007 CIVIWCVVOFNUST-SCFJQAPRSA-N	Bombykol 10E,12Z-hexadecadien-1-ol FOH 16:2 hexadeca-10E,12Z-dien-1-ol
metacyc.compound:CPD-16004 metacycM:CPD-16004 CIVIWCVVOFNUST-SCFJQAPRSA-N	bombykol (E,Z)-10,12-hexadecadien-1-ol 10E,12Z-hexadecadien-1-ol 765-17-3 hexadeca-10E,12Z-dien-1-ol isobombycol
chebi:37893 chebi:41197 keggC:M_C16873 seedM:M_cpd17169	secondary/obsolete/fantasy identifier