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3-geranyl-4-hydroxybenzoate

PropertiesImage
MNX_IDMNXM3841 Image of MNXM3841
referencechebi:60878
formulaC17H21O3
global charge-1
mol weight273.352
InChIKeyHKIMBCGCVPYUTJ-NTUHNPAUSA-M
InChIInChI=1S/C17H22O3/c1-12(2)5-4-6-13(3)7-8-14-11-15(17(19)20)9-10-16(14)18/h5,7,9-11,18H,4,6,8H2,1-3H3,(H,19,20)/p-1/b13-7+
SMILESCC(C)=CCC/C(C)=C/CC1=C(O)C=CC(C(=O)[O-])=C1
MNX internals
InChI (mnx)InChI=1/C17H22O3/c1-12(2)5-4-6-13(3)7-8-14-11-15(17(19)20)9-10-16(14)18/h5,7,9-11,18H,4,6,8H2,1-3H3,(H,19,20)/b13-7+ Image of MNXM3841
SMILES (mnx)[CH3:1][C:12]([CH3:2])=[CH:5][CH2:4][CH2:6]/[C:13]([CH3:3])=[CH:7]/[CH2:8][C:14]1=[C:16]([OH:18])[CH:10]=[CH:9][C:15]([C:17]([OH:19])=[O:20])=[CH:11]1
Parent-child relations graph
Occurences in reactions#reac
in my sandbox 0
in MNXref (generic)8
in models (compartimentalized) 0
Similar chemical compounds in external resources
IdentifierDescription

CHEBI:60878
chebi:60878
HKIMBCGCVPYUTJ-NTUHNPAUSA-M
3-geranyl-4-hydroxybenzoate
3-[(2E)-3,7-dimethylocta-2,6-dien-1-yl]-4-hydroxybenzoate
3-geranyl-4-hydroxybenzoate anion
3-geranyl-4-hydroxybenzoate(1-)

sabiork.compound:32023
sabiorkM:32023
HKIMBCGCVPYUTJ-NTUHNPAUSA-M
3-Geranyl-4-hydroxybenzoate

SLM:000598033
slm:000598033
HKIMBCGCVPYUTJ-NTUHNPAUSA-M
3-geranyl-4-hydroxybenzoate

metacyc.compound:CPD-9318
metacycM:CPD-9318
HKIMBCGCVPYUTJ-NTUHNPAUSA-M
3-geranyl-4-hydroxybenzoate
geranyl-4-hydroxybenzoate
geranyl-hydroxybenzoate
geranyl-p-hydroxybenzoate

CHEBI:61122
chebi:61122
HKIMBCGCVPYUTJ-NTUHNPAUSA-N
3-geranyl-4-hydroxybenzoic acid
3-[(2E)-3,7-dimethylocta-2,6-dien-1-yl]-4-hydroxybenzoic acid

seed.compound:cpd12785
seedM:cpd12785
4-Hydroxy-3-polyprenylbenzoate
hmdb:HMDB0060388
HKIMBCGCVPYUTJ-NTUHNPAUSA-N
4-Hydroxy-3-polyprenylbenzoate
3-[(2E)-3,7-dimethylocta-2,6-dien-1-yl]-4-hydroxybenzoic acid
4-Hydroxy-3-polyprenylbenzoic acid
4-hydroxy-3-polyprenylbenzoate

kegg.compound:C18131
keggC:C18131
HKIMBCGCVPYUTJ-NTUHNPAUSA-N
Geranyl-hydroxybenzoate

seed.compound:cpd19401
seedM:cpd19401
HKIMBCGCVPYUTJ-NTUHNPAUSA-M
Geranyl-hydroxybenzoate
3-geranyl-4-hydroxybenzoate
geranyl-4-hydroxybenzoate
geranyl-hydroxybenzoate
geranyl-p-hydroxybenzoate

hmdb:HMDB60388
keggC:M_C18131
seedM:M_cpd12785
seedM:M_cpd19401
secondary/obsolete/fantasy identifier