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alpha-guaiene

MNXM5049 is deprecated and here replaced by MNXM737345
!!! Alternative mappings exist !!!
PropertiesImage
MNX_IDMNXM737345 Image of MNXM737345
referencechebi:63443
formulaC15H24
global charge0
mol weight204.357
InChIKeyADIDQIZBYUABQK-RWMBFGLXSA-N
InChIInChI=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
SMILESC=C(C)[C@@H]1CC[C@H](C)C2=C(C1)[C@@H](C)CC2
MNX internals
InChI (mnx)InChI=1/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 Image of MNXM737345
SMILES (mnx)[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
Occurences in reactions#reac
in my sandbox 0
in MNXref (generic)1
in models (compartimentalized) 0
Similar chemical compounds in external resources
IdentifierDescription

CHEBI:63443
chebi:63443
ADIDQIZBYUABQK-RWMBFGLXSA-N 		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
ADIDQIZBYUABQK-RWMBFGLXSA-N 		alpha-Guaiene

seed.compound:cpd21394
seedM:cpd21394
ADIDQIZBYUABQK-RWMBFGLXSA-N 		alpha-Guaiene
alpha-guaiene

metacyc.compound:CPD-8749
metacycM:CPD-8749
ADIDQIZBYUABQK-RWMBFGLXSA-N 		alpha-guaiene

keggC:M_C20161
seedM:M_cpd21394 		secondary/obsolete/fantasy identifier