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alpha-guaiene

Properties

Image

with InChI numbering

Occurences in reactions

MNX_ID

MNXM737345

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

formula

C₁₅H₂₄

charge

mass

204.357

reference

InChIKey

ADIDQIZBYUABQK-RWMBFGLXSA-N

InChI

InChI=1S/C15H24/c1-10(2)13-7-5-11(3)14-8-6-12(4)15(14)9-13/h11-13H,1,5-9H2,2-4H3/t11-,12-,13+/m0/s1

SMILES

[CH2:1]=[C:10]([CH3:2])[C@@H:13]1[CH2:7][CH2:5][C@H:11]([CH3:3])[C:14]2=[C:15]([CH2:9]1)[C@@H:12]([CH3:4])[CH2:6][CH2:8]2

Parent-child relations graph

Deprecated MNXref IDs graph

Similar chemical compounds in external resources
Identifier	Description
CHEBI:63443 chebi:63443	alpha-guaiene (1S,4S,7R)-1,4-dimethyl-7-(prop-1-en-2-yl)-1,2,3,4,5,6,7,8-octahydroazulene guaia-1(5),11-diene
kegg.compound:C20161 keggC:C20161	alpha-Guaiene
hmdb:HMDB0036003	alpha-Guaiene 1,4-dimethyl-7-(prop-1-en-2-yl)-1,2,3,4,5,6,7,8-octahydroazulene 7-Isopropenyl-1,4-dimethyl-1,2,3,4,5,6,7,8-octahydroazulene a-Guaiene alpha-Guajene alpha-guaiene guaiene
seed.compound:cpd21394 seedM:cpd21394	alpha-Guaiene alpha-guaiene
metacyc.compound:CPD-8749 metacycM:CPD-8749	alpha-guaiene
hmdb:HMDB36003 keggC:M_C20161 seedM:M_cpd21394	secondary/obsolete/fantasy identifier