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gamma-tocotrienol

PropertiesImage
MNX_IDMNXM54335 Image of MNXM54335
referencechebi:33277
formulaC28H42O2
global charge0
mol weight410.642
InChIKeyOTXNTMVVOOBZCV-WAZJVIJMSA-N
InChIInChI=1S/C28H42O2/c1-20(2)11-8-12-21(3)13-9-14-22(4)15-10-17-28(7)18-16-25-19-26(29)23(5)24(6)27(25)30-28/h11,13,15,19,29H,8-10,12,14,16-18H2,1-7H3/b21-13+,22-15+/t28-/m1/s1
SMILESCC(C)=CCC/C(C)=C/CC/C(C)=C/CC[C@]1(C)CCC2=CC(O)=C(C)C(C)=C2O1
MNX internals
InChI (mnx)InChI=1/C28H42O2/c1-20(2)11-8-12-21(3)13-9-14-22(4)15-10-17-28(7)18-16-25-19-26(29)23(5)24(6)27(25)30-28/h11,13,15,19,29H,8-10,12,14,16-18H2,1-7H3/b21-13+,22-15+/t28-/m1/s1 Image of MNXM54335
SMILES (mnx)[CH3:1][C:20]([CH3:2])=[CH:11][CH2:8][CH2:12]/[C:21]([CH3:3])=[CH:13]/[CH2:9][CH2:14]/[C:22]([CH3:4])=[CH:15]/[CH2:10][CH2:17][C@:28]1([CH3:7])[CH2:18][CH2:16][C:25]2=[CH:19][C:26]([OH:29])=[C:23]([CH3:5])[C:24]([CH3:6])=[C:27]2[O:30]1
Parent-child relations graph
Occurences in reactions#reac
in my sandbox 0
in MNXref (generic)4
in models (compartimentalized) 2
Similar chemical compounds in external resources
IdentifierDescription

CHEBI:33277
chebi:33277
OTXNTMVVOOBZCV-WAZJVIJMSA-N 		gamma-tocotrienol
(2R)-2,7,8-trimethyl-2-[(3E,7E)-4,8,12-trimethyltrideca-3,7,11-trien-1-yl]-3,4-dihydro-2H-1-benzopyran-6-ol
(2R)-2,7,8-trimethyl-2-[(3E,7E)-4,8,12-trimethyltrideca-3,7,11-trien-1-yl]-3,4-dihydro-2H-chromen-6-ol

vmhM:M01938
vmhmetabolite:M01938
OTXNTMVVOOBZCV-WAZJVIJMSA-N 		Gama-Tocotrienol
(2R)-2,7,8-trimethyl-2-[(3E,7E)-4,8,12-trimethyltrideca-3,7,11-trien-1-yl]-3,4-dihydro-2H-1-benzopyran-6-ol

kegg.compound:C14155
keggC:C14155
OTXNTMVVOOBZCV-WAZJVIJMSA-N 		gamma-Tocotrienol
hmdb:HMDB0012958
OTXNTMVVOOBZCV-WAZJVIJMSA-N 		gamma-Tocotrienol
(2R)-2,7,8-Trimethyl-2-[(3E,7E)-4,8,12-trimethyltrideca-3,7,11-trien-1-yl]-3,4-dihydro-2H-1-benzopyran-6-ol
(2R)-2,7,8-trimethyl-2-[(3E,7E)-4,8,12-trimethyltrideca-3,7,11-trien-1-yl]-3,4-dihydro-2H-1-benzopyran-6-ol
(2R)-3,4-Dihydro-2,7,8-trimethyl-2-[(3E,7E)-4,8,12-trimethyl-3,7,11-tridecatrien-1-yl]-2H-1-benzopyran-6-ol
(R)-gamma-Tocotrienol
(R)-gamma-tocotrienol
7,8-Dimethyltocotrienol
D-gamma-Tocotrienol
D-gamma-tocotrienol
Plastochromanol 3
Tocotrienol, gamma
g-Tocotrienol
gamma-tocotrienol

seed.compound:cpd09854
seedM:cpd09854
OTXNTMVVOOBZCV-WAZJVIJMSA-N 		gamma-Tocotrienol
gamma-tocotrienol

metacyc.compound:CPD-15838
metacycM:CPD-15838
OTXNTMVVOOBZCV-WAZJVIJMSA-N 		gamma-tocotrienol

lipidmaps:LMPR02020057
lipidmapsM:LMPR02020057
OTXNTMVVOOBZCV-WAZJVIJMSA-N 		gamma-tocotrienol
2R,7,8-trimethyl-2-[(3E,7E)-4,8,12-trimethyltrideca-3,7,11-trien-1-yl]-3,4-dihydro-2H-chromen-6-ol

hmdb:HMDB12958
chebi:35082
keggC:M_C14155
seedM:M_cpd09854
vmhM:M_M01938 		secondary/obsolete/fantasy identifier