Search MNXref
 Feedback

deoxynivalenol

MNXM89039 is deprecated and here replaced by MNXM1108435
!!! Alternative mappings exist !!!
PropertiesImage
MNX_IDMNXM1108435 Image of MNXM1108435
referencechebi:10022
formulaC15H20O6
global charge0
mol weight296.319
InChIKeyLINOMUASTDIRTM-QGRHZQQGSA-N
InChIInChI=1S/C15H20O6/c1-7-3-9-14(5-16,11(19)10(7)18)13(2)4-8(17)12(21-9)15(13)6-20-15/h3,8-9,11-12,16-17,19H,4-6H2,1-2H3/t8-,9-,11-,12-,13-,14-,15+/m1/s1
SMILESCC1=C[C@H]2O[C@@H]3[C@H](O)C[C@](C)([C@@]2(CO)[C@H](O)C1=O)[C@]31CO1
MNX internals
InChI (mnx)InChI=1/C15H20O6/c1-7-3-9-14(5-16,11(19)10(7)18)13(2)4-8(17)12(21-9)15(13)6-20-15/h3,8-9,11-12,16-17,19H,4-6H2,1-2H3/t8-,9-,11-,12-,13-,14-,15+/m1/s1 Image of MNXM1108435
SMILES (mnx)[CH3:1][C:7]1=[CH:3][C@@H:9]2[C@:14]([CH2:5][OH:16])([C@H:11]([OH:19])[C:10]1=[O:18])[C@@:13]1([CH3:2])[CH2:4][C@@H:8]([OH:17])[C@H:12]([C@@:15]13[CH2:6][O:20]3)[O:21]2
Parent-child relations graph
Occurences in reactions#reac
in my sandbox 0
in MNXref (generic)0
in models (compartimentalized) 0
Similar chemical compounds in external resources
IdentifierDescription

CHEBI:10022
chebi:10022
LINOMUASTDIRTM-QGRHZQQGSA-N 		deoxynivalenol
3alpha,7alpha,15-trihydroxy-12,13-epoxytrichothec-9-en-8-one
4-Deoxynivalenol
4-Desoxynivalenol
DON
Dehydronivalenol
Desoxynivalenol
Vomitoxin

lipidmaps:LMPR0103180004
lipidmapsM:LMPR0103180004
LINOMUASTDIRTM-QGRHZQQGSA-N 		Deoxynivalenol

envipath:...1bb7a1191db1
envipathM:...1bb7a1191db1
LINOMUASTDIRTM-QGRHZQQGSA-N 		compound 0056395