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DIMBOA

MNXM734787 is deprecated and here replaced by MNXM1108153
!!! Alternative mappings exist !!!
PropertiesImage
MNX_IDMNXM1108153 Image of MNXM1108153
referencechebi:18048
formulaC9H9NO5
global charge0
mol weight211.173
InChIKeyGDNZNIJPBQATCZ-UHFFFAOYSA-N
InChIInChI=1S/C9H9NO5/c1-14-5-2-3-6-7(4-5)15-9(12)8(11)10(6)13/h2-4,9,12-13H,1H3
SMILESCOC1=CC2=C(C=C1)N(O)C(=O)C(O)O2
MNX internals
InChI (mnx)InChI=1/C9H9NO5/c1-14-5-2-3-6-7(4-5)15-9(12)8(11)10(6)13/h2-4,9,12-13H,1H3/t9? Image of MNXM1108153
SMILES (mnx)[CH3:1][O:14][C:5]1=[CH:4][C:7]2=[C:6]([CH:3]=[CH:2]1)[N:10]([OH:13])[C:8](=[O:11])[CH:9]([OH:12])[O:15]2
Parent-child relations graph
Occurences in reactions#reac
in my sandbox 0
in MNXref (generic)4
in models (compartimentalized) 2
Similar chemical compounds in external resources
IdentifierDescription

seed.compound:cpd02876
seedM:cpd02876
CHEBI:18048
chebi:18048
GDNZNIJPBQATCZ-UHFFFAOYSA-N 		DIMBOA
2,4-Dihydroxy-7-methoxy-1,4-benzoxazin-3-one
2,4-Dihydroxy-7-methoxy-2H-1,4-benzoxazin-3(4H)-one
2,4-dihydroxy-7-methoxy-2H-1,4-benzoxazin-3(4H)-one
hmdb:HMDB0034864
GDNZNIJPBQATCZ-UHFFFAOYSA-N 		2,4-Dihydroxy-7-methoxy-2H-1,4-benzoxazin-3(4H)-one
(+/-)-2,4-dihydroxy-7-methoxy-2H-1,4-benzoxazin-3(4H)-one
(2R)-2,4-Dihydroxy-7-methoxy-1,4-benzoxazin-3-one
2,4-Dihydroxy-7-(methyloxy)-2H-1,4-benzoxazin-3(4H)-one
2,4-Dihydroxy-7-methoxy-1,4-benzoxazin-3-one
2,4-Dihydroxy-7-methoxy-1,4-benzoxazinone
2,4-Dihydroxy-7-methoxy-2H,1,4-benzoxazin-3(4H)one
2,4-dihydroxy-7-methoxy-3,4-dihydro-2H-1,4-benzoxazin-3-one
DIMBOA
HBO
dimboa

sabiork.compound:7515
sabiorkM:7515
kegg.compound:C04720
keggC:C04720
GDNZNIJPBQATCZ-UHFFFAOYSA-N 		DIMBOA
2,4-Dihydroxy-7-methoxy-1,4-benzoxazin-3-one
2,4-Dihydroxy-7-methoxy-2H-1,4-benzoxazin-3(4H)-one

hmdb:HMDB34864
chebi:11442
chebi:19354
chebi:913
keggC:M_C04720
seedM:M_cpd02876 		secondary/obsolete/fantasy identifier