**This is a beta version of MetaNetX/MNXref, MNXref identifiers may not be final**

all-trans-capsorubin

Properties Image Occurences in reactions MNX_ID MNXM3556 #reac in my sandbox 0 in MNXref (generic) 2 in models (compartimentalized) 0 formula C40H56O4 charge 0 mass 600.884 reference chebi:3378 InChIKey GVOIABOMXKDDGU-YUURSNASSA-N InChI InChI=1S/C40H56O4/c1-29(17-13-19-31(3)21-23-35(43)39(9)27-33(41)25-37(39,5)6)15-11-12-16-30(2)18-14-20-32(4)22-24-36(44)40(10)28-34(42)26-38(40,7)8/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-,39-,40-/m0/s1 SMILES [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:36]([C@:40]1([CH3:10])[CH2:28][C@@H:34]([OH:42])[CH2:26][C:38]1([CH3:7])[CH3:8])=[O:44])/[CH:17]=[CH:13]/[CH:19]=[C:31]([CH3:3])/[CH:21]=[CH:23]/[C:35]([C@:39]1([CH3:9])[CH2:27][C@@H:33]([OH:41])[CH2:25][C:37]1([CH3:5])[CH3:6])=[O:43]

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Deprecated MNXref IDs graph

Similar chemical compounds in external resources

Identifier	Description
CHEBI:3378 chebi:3378	all-trans-capsorubin (3S,3'S,5R,5'R)-3,3'-dihydroxy-kappa,kappa-carotene-6,6'-dione (3S,5R,3'S,5'R)-3,3'-dihydroxy-kappa,kappa-carotene-6,6'-dione Capsorubin capsorubin
kegg.compound:C08585 keggC:C08585 lipidmaps:LMPR01070048 lipidmapsM:LMPR01070048	Capsorubin
hmdb:HMDB0036924	Capsorubin (2E,4E,6E,8E,10E,12E,14E,16E,18E)-1,20-bis[(1R,4S)-4-hydroxy-1,2,2-trimethylcyclopentyl]-4,8,13,17-tetramethylicosa-2,4,6,8,10,12,14,16,18-nonaene-1,20-dione (3S,5R,3's,5'r)-3,3'-Dihydroxy-kappa,kappa-carotene-6,6'-dione 3,3'-Dihydroxy-K,K-carotene-6,6'-dione 3,3'-Dihyroxy-kappa,kappa-carotene-6,6'-dione all-trans-Capsorubin capsorubin e160 (Capsorubin)
seed.compound:cpd05492 seedM:cpd05492	Capsorubin capsorubin
SLM:000501416 slm:000501416	all-trans-capsorubin
metacyc.compound:CAPSORUBIN metacycM:CAPSORUBIN	capsorubin
hmdb:HMDB36924 keggC:M_C08585 seedM:M_cpd05492	secondary/obsolete/fantasy identifier