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8'-(3,4-dihydroxy-5-alkenyl)phenyl-3-[9'E,11'E,13'Z-pentadecatrienyl]catechol

Properties

Image

Occurences in reactions

MNX_ID

MNXM15076

	#reac
in my sandbox	0
in MNXref (generic)	2
in models (compartimentalized)	0

formula

C₄₂H₅₈O₄

charge

mass

626.43351

reference

metacycM:CPD-12632

InChIKey

RRISDBXWLOLICW-VXLUQKRESA-N

InChI

InChI=1S/C42H58O4/c1-3-5-7-9-10-11-12-13-14-15-16-19-25-30-37-33-38(34-40(44)42(37)46)35(27-22-18-8-6-4-2)28-23-20-17-21-24-29-36-31-26-32-39(43)41(36)45/h3-11,18,22,26-27,31-35,43-46H,12-17,19-21,23-25,28-30H2,1-2H3/b5-3-,6-4-,9-7+,11-10-,18-8+,27-22+

SMILES

C/C=C\C=C\C=C/CCCCCCCCc1cc(C(/C=C/C=C/C=C\C)CCCCCCCc2cccc(O)c2O)cc(O)c1O

Parent-child relations graph

Deprecated MNXref IDs graph

Similar chemical compounds in external resources
Identifier	Description
metacyc.compound:CPD-12632 metacycM:CPD-12632	8'-(3,4-dihydroxy-5-alkenyl)phenyl-3-[9'E,11'E,13'Z-pentadecatrienyl]catechol urushiol dimer
seed.compound:cpd23503 seedM:cpd23503	8'-(3,4-dihydroxy-5-alkenyl)phenyl-3-[9'E,11'E-pentadecatrienyl]catechol 8'-(3,4-dihydroxy-5-alkenyl)phenyl-3-[9'E,11'E,13'Z-pentadecatrienyl]catechol urushiol dimer
seedM:M_cpd23503	secondary/obsolete/fantasy identifier