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(3E)-3,4-didehydrorhodopin

PropertiesImage
MNX_IDMNXM3123 Image of MNXM3123
referencechebi:62481
formulaC40H56O
global charge0
mol weight552.887
InChIKeyYNXUITAACINYQG-VWQKURAKSA-N
InChIInChI=1S/C40H56O/c1-33(2)19-13-22-36(5)25-16-28-37(6)26-14-23-34(3)20-11-12-21-35(4)24-15-27-38(7)29-17-30-39(8)31-18-32-40(9,10)41/h11-12,14-21,23-31,41H,13,22,32H2,1-10H3/b12-11+,23-14+,24-15+,28-16+,29-17+,31-18+,34-20+,35-21+,36-25+,37-26+,38-27+,39-30+
SMILESCC(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)/C=C/CC(C)(C)O
MNX internals
InChI (mnx)InChI=1/C40H56O/c1-33(2)19-13-22-36(5)25-16-28-37(6)26-14-23-34(3)20-11-12-21-35(4)24-15-27-38(7)29-17-30-39(8)31-18-32-40(9,10)41/h11-12,14-21,23-31,41H,13,22,32H2,1-10H3/b12-11+,23-14+,24-15+,28-16+,29-17+,31-18+,34-20+,35-21+,36-25+,37-26+,38-27+,39-30+ Image of MNXM3123
SMILES (mnx)[CH3:1][C:33]([CH3:2])=[CH:19][CH2:13][CH2:22]/[C:36]([CH3:5])=[CH:25]/[CH:16]=[CH:28]/[C:37]([CH3:6])=[CH:26]/[CH:14]=[CH:23]/[C:34]([CH3:3])=[CH:20]/[CH:11]=[CH:12]/[CH:21]=[C:35]([CH3:4])/[CH:24]=[CH:15]/[CH:27]=[C:38]([CH3:7])/[CH:29]=[CH:17]/[CH:30]=[C:39]([CH3:8])/[CH:31]=[CH:18]/[CH2:32][C:40]([CH3:9])([CH3:10])[OH:41]
Parent-child relations graph
Occurences in reactions#reac
in my sandbox 0
in MNXref (generic)7
in models (compartimentalized) 0
Similar chemical compounds in external resources
IdentifierDescription

CHEBI:62481
chebi:62481
YNXUITAACINYQG-VWQKURAKSA-N 		(3E)-3,4-didehydrorhodopin
(3E)-3,4-dehydrorhodopin
(3E)-3,4-didehydro-1,2-dihydro-1-hydroxy-psi,psi-carotene
(3E)-3,4-didehydro-1,2-dihydro-psi,psi-caroten-1-ol
(4E,6E,8S,10E,12E,14E,16E,18E,20Z,22Z,24Z,26Z)-2,6,10,14,19,23,27,31-octamethyldotriaconta-4,6,8,10,12,14,16,18,20,22,24,26,30-tridecaen-2-ol
1-hydroxy-3,4-didehydro-1,2-dihydrolycopene
3,4-Didehydrorhodopin
3,4-dehydrorhodopin
all-trans-2,6,10,14,19,23,27,31-octamethyldotriaconta-4,6,8,10,12,14,16,18,20,22,24,26,30-tridecaen-2-ol
all-trans-3,4-didehydrorhodopin

lipidmaps:LMPR01070115
lipidmapsM:LMPR01070115
YNXUITAACINYQG-VWQKURAKSA-N 		1-Hydroxy-3,4-didehydrolycopene
3,4-Dehydrorhodopin
3,4-Didehydro-1,2-dihydro-psi,psi-caroten-1-ol
3,4-Didehydrorhodopin

vmhM:34dhrdpn
vmhmetabolite:34dhrdpn
YNXUITAACINYQG-VWQKURAKSA-N 		3,4-Dehydrorhodopin

seed.compound:cpd14605
seedM:cpd14605
YNXUITAACINYQG-VWQKURAKSA-N 		3,4-Dehydrorhodopin
1-Hydroxy-3,4-didehydro-1,2-dihydrolycopene
1-hydroxy-3,4-didehydrolycopene
3,4-Didehydrorhodopin
3,4-dehydrorhodopin
3,4-didehydrorhodopin

kegg.compound:C15874
keggC:C15874
YNXUITAACINYQG-VWQKURAKSA-N 		3,4-Dehydrorhodopin
1-Hydroxy-3,4-didehydro-1,2-dihydrolycopene
3,4-Didehydrorhodopin

metacyc.compound:CPD-12611
metacycM:CPD-12611
YNXUITAACINYQG-VWQKURAKSA-N 		3,4-didehydrorhodopin
1-hydroxy-3,4-didehydrolycopene
3,4-dehydrorhodopin

keggC:M_C15874
seedM:M_cpd14605
vmhM:M_34dhrdpn 		secondary/obsolete/fantasy identifier