MetaNetX
Automated Model Construction and Genome Annotation for Large-Scale Metabolic Networks

Feedback

all-trans-lycopene

	Properties	Image
MNX_ID	MNXM1364638
reference	chebi:15948
formula	C₄₀H₅₆
global charge	0
mol weight	536.888
InChIKey	OAIJSZIZWZSQBC-GYZMGTAESA-N
InChI	InChI=1S/C40H56/c1-33(2)19-13-23-37(7)27-17-31-39(9)29-15-25-35(5)21-11-12-22-36(6)26-16-30-40(10)32-18-28-38(8)24-14-20-34(3)4/h11-12,15-22,25-32H,13-14,23-24H2,1-10H3/b12-11+,25-15+,26-16+,31-17+,32-18+,35-21+,36-22+,37-27+,38-28+,39-29+,40-30+
SMILES	CC(C)=CCC/C(C)=C/C=C/C(C)=C/C=C/C(C)=C/C=C/C=C(C)/C=C/C=C(C)/C=C/C=C(\C)CCC=C(C)C

MNX internals

InChI (mnx)	InChI=1/C40H56/c1-33(2)19-13-23-37(7)27-17-31-39(9)29-15-25-35(5)21-11-12-22-36(6)26-16-30-40(10)32-18-28-38(8)24-14-20-34(3)4/h11-12,15-22,25-32H,13-14,23-24H2,1-10H3/b12-11+,25-15+,26-16+,31-17+,32-18+,35-21+,36-22+,37-27+,38-28+,39-29+,40-30+
SMILES (mnx)	[CH3:1][C:33]([CH3:2])=[CH:19][CH2:13][CH2:23]/[C:37]([CH3:7])=[CH:27]/[CH:17]=[CH:31]/[C:39]([CH3:9])=[CH:29]/[CH:15]=[CH:25]/[C:35]([CH3:5])=[CH:21]/[CH:11]=[CH:12]/[CH:22]=[C:36]([CH3:6])/[CH:26]=[CH:16]/[CH:30]=[C:40]([CH3:10])/[CH:32]=[CH:18]/[CH:28]=[C:38](\[CH3:8])[CH2:24][CH2:14][CH:20]=[C:34]([CH3:3])[CH3:4]

Parent-child relations graph

Occurences in reactions	#reac
in my sandbox	0
in MNXref (generic)	44
in models (compartimentalized)	6

Similar chemical compounds in external resources
Identifier	Description
CHEBI:15948 chebi:15948 OAIJSZIZWZSQBC-GYZMGTAESA-N	all-trans-lycopene (6E,8E,10E,12E,14E,16E,18E,20E,22E,24E,26E)-2,6,10,14,19,23,27,31-octamethyldotriaconta-2,6,8,10,12,14,16,18,20,22,24,26,30-tridecaene LYCOPENE Lycopene lycopene psi,psi-carotene
sabiork.compound:7906 sabiorkM:7906 OAIJSZIZWZSQBC-GYZMGTAESA-N	Lycopene
hmdb:HMDB0003000 OAIJSZIZWZSQBC-GYZMGTAESA-N	Lycopene (6E,8E,10E,12E,14E,16E,18E,20E,22E,24E,26E)-2,6,10,14,19,23,27,31-Octamethyl-2,6,8,10,12,14,16,18,20,22,24,26,30-dotriacontatridecaene (6E,8E,10E,12E,14E,16E,18E,20E,22E,24E,26E)-2,6,10,14,19,23,27,31-Octamethyldotriaconta-2,6,8,10,12,14,16,18,20,22,24,26,30-tridecaene (6E,8E,10E,12E,14E,16E,18E,20E,22E,24E,26E)-2,6,10,14,19,23,27,31-octamethyldotriaconta-2,6,8,10,12,14,16,18,20,22,24,26,30-tridecaene (all-E)-Lycopene (all-e)-2,6,10,14,19,23,27,31-Octamethyl-2,6,8,10,12,14,16,18,20,22,24,26,30-dotriacontatridecaene LYC O mato LYCOMATO Pro lycopene Pro-lycopene all trans Lycopene all-trans-Lycopene lycopene psi,psi-Carotene trans-Lycopene
vmhM:lcpn vmhmetabolite:lcpn OAIJSZIZWZSQBC-GYZMGTAESA-N	Lycopene (6E,8E,10E,12E,14E,16E,18E,20E,22E,24E,26E)-2,6,10,14,19,23,27,31-octamethyldotriaconta-2,6,8,10,12,14,16,18,20,22,24,26,30-tridecaene
kegg.compound:C05432 keggC:C05432 OAIJSZIZWZSQBC-GYZMGTAESA-N	Lycopene all-trans-Lycopene
seed.compound:cpd03217 seedM:cpd03217 OAIJSZIZWZSQBC-GYZMGTAESA-N	Lycopene all-trans-Lycopene all-trans-lycopene psi,psi-carotene
lipidmaps:LMPR01070257 lipidmapsM:LMPR01070257 OAIJSZIZWZSQBC-GYZMGTAESA-N	Lycopene psi,psi-Carotene
metacyc.compound:CPD1F-114 metacycM:CPD1F-114 OAIJSZIZWZSQBC-GYZMGTAESA-N	all-trans-lycopene psi,psi-carotene
SLM:000501173 slm:000501173 OAIJSZIZWZSQBC-GYZMGTAESA-N	lycopene
hmdb:HMDB03000 chebi:14541 chebi:26367 chebi:43789 chebi:6596 keggC:M_C05432 seedM:M_cpd03217 vmhM:M_lcpn	secondary/obsolete/fantasy identifier