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all-trans-violaxanthin

Properties

Image

Occurences in reactions

MNX_ID

MNXM738452

	#reac
in my sandbox	0
in MNXref (generic)	25
in models (compartimentalized)	2

formula

C₄₀H₅₆O₄

charge

mass

600.41786

reference

chebi:35288

InChIKey

SZCBXWMUOPQSOX-WVJDLNGLSA-N

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

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

Parent-child relations graph

Deprecated MNXref IDs graph

Similar chemical compounds in external resources
Identifier	Description
CHEBI:35288 chebi:35288	all-trans-violaxanthin (3S,3'S,5R,5'R,6S,6'S)-5,5',6,6'-tetrahydro-5,6:5',6'-diepoxy-beta,beta-carotene-3,3'-diol (3S,3'S,5R,5'R,6S,6'S)-5,6:5',6'-diepoxy-5,5',6,6'-tetrahydro-beta,beta-carotene-3,3'-diol (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 E 161e Violaxanthin all-trans-Violaxanthin
lipidmaps:LMPR01070282 lipidmapsM:LMPR01070282	Violaxanthin
seed.compound:cpd05521 seedM:cpd05521	Violaxanthin 5,6,5',6'-diepoxy-5,6,5',6'-tetrahydro-beta,beta-carotene-3,3'-diol all-trans-Violaxanthin violaxanthin
kegg.compound:C08614 keggC:C08614	Violaxanthin all-trans-Violaxanthin
metacyc.compound:CPD1F-133 metacycM:CPD1F-133	violaxanthin 5,6,5',6'-diepoxy-5,6,5',6'-tetrahydro-beta,beta-carotene-3,3'-diol
chebi:22351 chebi:46568 chebi:9993 keggC:M_C08614 seedM:M_cpd05521	secondary/obsolete/fantasy identifier