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lactucaxanthin

Properties

Image

Occurences in reactions

MNX_ID

MNXM59676

	#reac
in my sandbox	0
in MNXref (generic)	1
in models (compartimentalized)	0

formula

C₄₀H₅₆O₂

charge

mass

568.42803

reference

chebi:6357

InChIKey

BIPAHAFBQLWRMC-SUOWZELTSA-N

InChI

InChI=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/h11-26,35-38,41-42H,27-28H2,1-10H3/b12-11+,17-13+,18-14+,23-21+,24-22+,29-15+,30-16+,31-19+,32-20+/t35-,36-,37-,38-/m0/s1

SMILES

CC1=C[C@H](O)CC(C)(C)[C@H]1/C=C/C(C)=C/C=C/C(C)=C/C=C/C=C(C)/C=C/C=C(C)/C=C/[C@H]1C(C)=C[C@H](O)CC1(C)C

Parent-child relations graph

Deprecated MNXref IDs graph

Similar chemical compounds in external resources
Identifier	Description
CHEBI:6357 chebi:6357	lactucaxanthin (3S,3'S,6S,6'S)-epsilon,epsilon-carotene-3,3'-diol Lactucaxanthin
kegg.compound:C08599 keggC:C08599 lipidmaps:LMPR01070273 lipidmapsM:LMPR01070273	Lactucaxanthin
hmdb:HMDB0112256	Lactucaxanthin (1R,4R)-4-[(1E,3E,5E,7E,9E,11E,13E,15E,17E)-18-[(1R,4R)-4-hydroxy-2,6,6-trimethylcyclohex-2-en-1-yl]-3,7,12,16-tetramethyloctadeca-1,3,5,7,9,11,13,15,17-nonaen-1-yl]-3,5,5-trimethylcyclohex-2-en-1-ol (3S,3's,6S,6's)-epsilon,epsilon-Carotene-3,3'-diol (3S,3's,6S,6's)-epsilon,epsilon-carotene-3,3'-diol Tunaxanthin F lactucaxanthin
seed.compound:cpd05506 seedM:cpd05506	Lactucaxanthin epsilon,epsilon-carotene-3,3'-diol lactucaxanthin
metacyc.compound:CPD-7416 metacycM:CPD-7416	lactucaxanthin epsilon,epsilon-carotene-3,3'-diol
keggC:M_C08599 seedM:M_cpd05506	secondary/obsolete/fantasy identifier