all-trans-violaxanthin (CHEBI:35288)

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CHEBI:35288 - all-trans-violaxanthin

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ChEBI Name	all-trans-violaxanthin

ChEBI ID	CHEBI:35288

ChEBI ASCII Name	all-trans-violaxanthin

Definition	The all-trans-stereoisomer of violaxanthin.

Stars	This entity has been manually annotated by the ChEBI Team.

Secondary ChEBI IDs	CHEBI:46568, CHEBI:9993, CHEBI:22351

Supplier Information	ZINC000008221270

Download	Molfile XML SDF

more structures >>

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M END): 33 ms

reading 100 atoms

ModelSet: haveSymmetry:false haveUnitcells:false haveFractionalCoord:false

1 model in this collection. Use getProperty "modelInfo" or getProperty "auxiliaryInfo" to inspect them.

Default Van der Waals type for model set to Babel

100 atoms created

ModelSet: not autobonding; use forceAutobond=true to force automatic bond creation

Script completed

Jmol script terminated

Molfile expand

Wikipedia	License
[object Object]
Read full article at Wikipedia

Formula

C40H56O4

Net Charge

Average Mass

600.87024

Monoisotopic Mass

600.41786

InChI

InChI=1S/C40H56O4/c1-29(17-13-19-31(3)21-23-39-35(5,6)25-33(41)27-37(39,9)43-39)15-11-12-16-30(2)18-14-20-32(4)22-24-40-36(7,8)26-34(42)28-38(40,10)44-40/h11-24,33-34,41-42H,25-28H2,1-10H3/b12-11+,17-13+,18-14+,23-21+,24-22+,29-15+,30-16+,31-19+,32-20+/t33-,34-,37+,38+,39-,40-/m0/s1

InChIKey

SZCBXWMUOPQSOX-WVJDLNGLSA-N

SMILES

CC(\C=C\C=C(C)\C=C\[C@@]12O[C@]1(C)C[C@@H](O)CC2(C)C)=C/C=C/C=C(C)/C=C/C=C(C)/C=C/[C@@]12O[C@]1(C)C[C@@H](O)CC2(C)C

Roles Classification
Biological Role(s):	food colouring A food additive that imparts colour to food. In European countries, E-numbers for permitted food colours are from E 100 to E 199, divided into yellows (E 100-109), oranges (E 110-119), reds (E 120-129), blues and violets (E 130-139), greens (E 140-149), browns and blacks (E 150-159), and others (E 160-199). plant metabolite Any eukaryotic metabolite produced during a metabolic reaction in plants, the kingdom that include flowering plants, conifers and other gymnosperms. (via violaxanthin )

Application(s):	food colouring A food additive that imparts colour to food. In European countries, E-numbers for permitted food colours are from E 100 to E 199, divided into yellows (E 100-109), oranges (E 110-119), reds (E 120-129), blues and violets (E 130-139), greens (E 140-149), browns and blacks (E 150-159), and others (E 160-199).

View more via ChEBI Ontology

ChEBI Ontology
Outgoing	all-trans-violaxanthin (CHEBI:35288) has role food colouring (CHEBI:77182) all-trans-violaxanthin (CHEBI:35288) is a violaxanthin (CHEBI:27295)

IUPAC Name

(3S,3'S,5R,5'R,6S,6'S)-5,5',6,6'-tetrahydro-5,6:5',6'-diepoxy-β,β-carotene-3,3'-diol

Synonyms	Sources
(3S,3'S,5R,5'R,6S,6'S)-5,6:5',6'-diepoxy-5,5',6,6'-tetrahydro-β,β-carotene-3,3'-diol	ChemIDplus
(3S,5R,6S,3'S,5'R,6'S)-5,6,5',6'-DIEPOXY-5,6,5',6'-TETRAHYDRO-BETA,BETA-CAROTENE-3,3'-DIOL	PDBeChem
all-trans-Violaxanthin	KEGG COMPOUND
all-trans-violaxanthin	UniProt
E 161e	ChEBI
Violaxanthin	KEGG COMPOUND

Manual Xrefs	Databases
C00003787	KNApSAcK
C08614	KEGG COMPOUND
CPD1F-133	MetaCyc
HMDB0003101	HMDB
LMPR01070282	LIPID MAPS
MOL000096	COMe
Violaxanthin	Wikipedia
XAT	PDBeChem
View more database links

Registry Numbers	Types	Sources
101269	Reaxys Registry Number	Reaxys
126-29-4	CAS Registry Number	ChemIDplus

Citations

Last Modified

28 July 2014

CHEBI:35288 - all-trans-violaxanthin

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