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methyl (2E,6E)-farnesoate

Properties

Image

Occurences in reactions

MNX_ID

MNXM5369

	#reac
in my sandbox	0
in MNXref (generic)	8
in models (compartimentalized)	1

formula

C₁₆H₂₆O₂

charge

mass

250.382

reference

InChIKey

NWKXNIPBVLQYAB-VDQVFBMKSA-N

InChI

InChI=1S/C16H26O2/c1-13(2)8-6-9-14(3)10-7-11-15(4)12-16(17)18-5/h8,10,12H,6-7,9,11H2,1-5H3/b14-10+,15-12+

SMILES

[CH3:1][C:13]([CH3:2])=[CH:8][CH2:6][CH2:9]/[C:14]([CH3:3])=[CH:10]/[CH2:7][CH2:11]/[C:15]([CH3:4])=[CH:12]/[C:16](=[O:17])[O:18][CH3:5]

Parent-child relations graph

Deprecated MNXref IDs graph

Similar chemical compounds in external resources
Identifier	Description
CHEBI:80535 chebi:80535	methyl (2E,6E)-farnesoate (2E,6E)-farnesyl methyl ester Methyl 3,7,11-trimethyl-2,6,10-dodecatrienoate Methyl farnesate methyl (2-trans,6-trans)-farnesoate methyl (2E,6E)-3,7,11-trimethyldodeca-2,6,10-trienoate methyl (E,E)-farnesate methyl farnesoate
seed.compound:cpd16291 seedM:cpd16291	Methyl farnesoate (2E,6E)-3,7,11-trimethyl-dodeca-2,6,10-trienoic acid methyl ester (2E,6E)-farnesyl methyl ester (trans,trans)-2,6,10-dodecatrienoic acid, 3,7,11-trimethyl-, methyl ester 2,6,10-Dodecatrienoic acid, 3,7,11-trimethyl-, methyl ester, (2E,6E)- 2,6,10-Dodecatrienoic acid, 3,7,11-trimethyl-, methyl ester, (E,E)- Methyl (2E,6E)-3,7,11-trimethyl-2,6,10-dodecatrienoate methyl (2-trans-6-trans)-farnesoate methyl (2E,6E)-farnesoate methyl (trans,trans)-farnesoate
kegg.compound:C16503 keggC:C16503	Methyl farnesoate Methyl (2E,6E)-farnesoate
metacyc.compound:CPD-12586 metacycM:CPD-12586	methyl (2E,6E)-farnesoate (2E,6E)-3,7,11-trimethyl-dodeca-2,6,10-trienoic acid methyl ester (2E,6E)-farnesyl methyl ester (trans,trans)-2,6,10-dodecatrienoic acid, 3,7,11-trimethyl-, methyl ester 2,6,10-Dodecatrienoic acid, 3,7,11-trimethyl-, methyl ester, (2E,6E)- 2,6,10-Dodecatrienoic acid, 3,7,11-trimethyl-, methyl ester, (E,E)- Methyl (2E,6E)-3,7,11-trimethyl-2,6,10-dodecatrienoate methyl (2-trans-6-trans)-farnesoate methyl (trans,trans)-farnesoate
keggC:M_C16503 seedM:M_cpd16291	secondary/obsolete/fantasy identifier