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3-[(8Z,11E,13Z)-pentadeca-8,11,13-trien-1-yl] )catechol

PropertiesImage
MNX_IDMNXM8881 Image of MNXM8881
referencemetacycM:CPD-12620
formulaC21H30O2
global charge0
mol weight314.469
InChIKeyIYROWZYPEIMDDN-XTUOKWOTSA-N
InChIInChI=1S/C21H30O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-16-19-17-15-18-20(22)21(19)23/h2-5,7-8,15,17-18,22-23H,6,9-14,16H2,1H3/b3-2-,5-4+,8-7-
SMILESC/C=C\C=C\C/C=C\CCCCCCCC1=CC=CC(O)=C1O
MNX internals
InChI (mnx)InChI=1/C21H30O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-16-19-17-15-18-20(22)21(19)23/h2-5,7-8,15,17-18,22-23H,6,9-14,16H2,1H3/b3-2-,5-4+,8-7- Image of MNXM8881
SMILES (mnx)[CH3:1]/[CH:2]=[CH:3]\[CH:4]=[CH:5]\[CH2:6]/[CH:7]=[CH:8]\[CH2:9][CH2:10][CH2:11][CH2:12][CH2:13][CH2:14][CH2:16][C:19]1=[C:21]([OH:23])[C:20]([OH:22])=[CH:18][CH:15]=[CH:17]1
Parent-child relations graph
Occurences in reactions#reac
in my sandbox 0
in MNXref (generic)5
in models (compartimentalized) 0
Similar chemical compounds in external resources
IdentifierDescription

metacyc.compound:CPD-12620
metacycM:CPD-12620
IYROWZYPEIMDDN-XTUOKWOTSA-N 		3-[(8Z,11E,13Z)-pentadeca-8,11,13-trien-1-yl] )catechol
3-[(8Z,11E,13Z)-pentadeca-8,11,13-trien-1-yl]benzene-1,2-diol
urushiol

lipidmaps:LMPK15020004
lipidmapsM:LMPK15020004
IYROWZYPEIMDDN-XTUOKWOTSA-N 		3-((8Z,11E,13Z)-pentadeca-8,11,13-trien-1-yl)catechol
3-((8Z,11E,13Z)-pentadeca-8,11,13-trien-1-yl)benzene-1,2-diol

seed.compound:cpd23496
seedM:cpd23496
IYROWZYPEIMDDN-XTUOKWOTSA-N 		3-(8'Z,11' E,13' Z-pentadecatrienyl )catechol
3-[(8Z,11E,13Z)-pentadeca-8,11,13-trien-1-yl] )catechol
3-[(8Z,11E,13Z)-pentadeca-8,11,13-trien-1-yl]benzene-1,2-diol

seedM:M_cpd23496 		secondary/obsolete/fantasy identifier