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all-trans-zeaxanthin

PropertiesImage
MNX_IDMNXM1364630 Image of MNXM1364630
referencechebi:27547
formulaC40H56O2
global charge0
mol weight568.886
InChIKeyJKQXZKUSFCKOGQ-QAYBQHTQSA-N
InChIInChI=1S/C40H56O2/c1-29(17-13-19-31(3)21-23-37-33(5)25-35(41)27-39(37,7)8)15-11-12-16-30(2)18-14-20-32(4)22-24-38-34(6)26-36(42)28-40(38,9)10/h11-24,35-36,41-42H,25-28H2,1-10H3/b12-11+,17-13+,18-14+,23-21+,24-22+,29-15+,30-16+,31-19+,32-20+/t35-,36-/m1/s1
SMILESCC1=C(/C=C/C(C)=C/C=C/C(C)=C/C=C/C=C(C)/C=C/C=C(C)/C=C/C2=C(C)C[C@@H](O)CC2(C)C)C(C)(C)C[C@H](O)C1
MNX internals
InChI (mnx)InChI=1/C40H56O2/c1-29(17-13-19-31(3)21-23-37-33(5)25-35(41)27-39(37,7)8)15-11-12-16-30(2)18-14-20-32(4)22-24-38-34(6)26-36(42)28-40(38,9)10/h11-24,35-36,41-42H,25-28H2,1-10H3/b12-11+,17-13+,18-14+,23-21+,24-22+,29-15+,30-16+,31-19+,32-20+/t35-,36-/m1/s1 Image of MNXM1364630
SMILES (mnx)[CH3:1][C:29](=[CH:15]\[CH:11]=[CH:12]\[CH:16]=[C:30]([CH3:2])\[CH:18]=[CH:14]\[CH:20]=[C:32]([CH3:4])\[CH:22]=[CH:24]\[C:38]1=[C:34]([CH3:6])[CH2:26][C@@H:36]([OH:42])[CH2:28][C:40]1([CH3:9])[CH3:10])/[CH:17]=[CH:13]/[CH:19]=[C:31]([CH3:3])/[CH:21]=[CH:23]/[C:37]1=[C:33]([CH3:5])[CH2:25][C@@H:35]([OH:41])[CH2:27][C:39]1([CH3:7])[CH3:8]
Parent-child relations graph
Occurences in reactions#reac
in my sandbox 0
in MNXref (generic)73
in models (compartimentalized) 14
Similar chemical compounds in external resources
IdentifierDescription

CHEBI:27547
chebi:27547
JKQXZKUSFCKOGQ-QAYBQHTQSA-N 		all-trans-zeaxanthin
(3R,3'R)-beta,beta-carotene-3,3'-diol
(3R,3'R)-dihydroxy-beta,beta-carotene
Zeaxanthin
all-trans-beta-carotene-3,3'-diol
anchovyxanthin
beta,beta-carotene-3,3'-diol
zeaxanthin

bigg.metabolite:zeax
biggM:zeax
lipidmaps:LMPR01070261
lipidmapsM:LMPR01070261
JKQXZKUSFCKOGQ-QAYBQHTQSA-N 		Zeaxanthin
hmdb:HMDB0002789
JKQXZKUSFCKOGQ-QAYBQHTQSA-N 		Zeaxanthin
(1R)-4-[(1E,3E,5E,7E,9E,11E,13E,15E,17E)-18-[(4R)-4-hydroxy-2,6,6-trimethylcyclohex-1-en-1-yl]-3,7,12,16-tetramethyloctadeca-1,3,5,7,9,11,13,15,17-nonaen-1-yl]-3,5,5-trimethylcyclohex-3-en-1-ol
(3R,3'R)-Dihydroxy-beta-carotene
(3R,3'R)-Zeaxanthin
(3R,3'R)-beta,beta-Carotene-3,3'-diol
(3R,3'r)-Dihydroxy-b,b-carotene
(3R,3'r)-Dihydroxy-beta,beta-carotene
(3R,3'r)-Zeaxanthin
(3R,3'r)-b,b-Carotene-3,3'-diol
(3R,3'r)-beta,beta-Carotene-3,3'-diol
(3R,3'r)-beta,beta-carotene-3,3'-diol
3R,3'r Zeaxanthin
3R,3'r-Zeaxanthin
Anchovyxanthin
Beta Carotene 3,3' diol
Xanthophyll 3
Zeaxanthins
Zeaxanthol
all-E-Zeaxanthin
all-trans-3R,3'R-Zeaxanthin
all-trans-Anchovyxanthin
all-trans-Zeaxanthin
all-trans-b-Carotene-3,3'-diol
all-trans-beta-Carotene-3,3'-diol
all-trans-beta-carotene-3,3'-diol
b,b-Carotene-3,3'-diol
beta,beta-Carotene-3,3'-diol
beta,beta-carotene-3,3'-diol
beta-Carotene-3,3'-diol
zeaxanthin

kegg.compound:C06098
keggC:C06098
JKQXZKUSFCKOGQ-QAYBQHTQSA-N 		Zeaxanthin
(3R,3'R)-beta,beta-Carotene-3,3'-diol

seed.compound:cpd03637
seedM:cpd03637
JKQXZKUSFCKOGQ-QAYBQHTQSA-N 		Zeaxanthin
(3R,3'R)-beta,beta-carotene-3,3'-diol
beta,beta-carotene-3,3'-diol
zeaxanthin

SLM:000501111
slm:000501111
JKQXZKUSFCKOGQ-QAYBQHTQSA-N 		zeaxanthin

metacyc.compound:CPD1F-130
metacycM:CPD1F-130
JKQXZKUSFCKOGQ-QAYBQHTQSA-N 		zeaxanthin
(3R,3'R)-beta,beta-carotene-3,3'-diol

hmdb:HMDB02789
chebi:10108
chebi:27361
biggM:M_zeax
keggC:M_C06098
seedM:M_cpd03637 		secondary/obsolete/fantasy identifier