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3-(all-trans-heptaprenyl)benzene-1,2-diol

Properties

Image

Occurences in reactions

MNX_ID

MNXM9976

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

formula

C₄₁H₆₂O₂

charge

mass

586.47498

reference

chebi:84516

InChIKey

OOYKEXOZUBWOSX-NFDZFSPWSA-N

InChI

InChI=1S/C41H62O2/c1-32(2)16-9-17-33(3)18-10-19-34(4)20-11-21-35(5)22-12-23-36(6)24-13-25-37(7)26-14-27-38(8)30-31-39-28-15-29-40(42)41(39)43/h15-16,18,20,22,24,26,28-30,42-43H,9-14,17,19,21,23,25,27,31H2,1-8H3/b33-18+,34-20+,35-22+,36-24+,37-26+,38-30+

SMILES

CC(C)=CCC/C(C)=C/CC/C(C)=C/CC/C(C)=C/CC/C(C)=C/CC/C(C)=C/CC/C(C)=C/Cc1cccc(O)c1O

Parent-child relations graph

Deprecated MNXref IDs graph

Similar chemical compounds in external resources
Identifier	Description
CHEBI:84516 chebi:84516	3-(all-trans-heptaprenyl)benzene-1,2-diol 2-heptaprenyl-6-hydroxyphenol 3-[(2E,6E,10E,14E,18E,22E)-3,7,11,15,19,23,27-heptamethyloctacosa-2,6,10,14,18,22,26-heptaen-1-yl]benzene-1,2-diol
seed.compound:cpd25874 seedM:cpd25874	2-heptaprenyl-6-hydroxyphenol 3-(all-trans-heptaprenyl)benzene-1,2-diol
metacyc.compound:CPD-9854 metacycM:CPD-9854	3-(all-trans-heptaprenyl)benzene-1,2-diol 2-heptaprenyl-6-hydroxyphenol
seedM:M_cpd25874	secondary/obsolete/fantasy identifier