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norbelladine

PropertiesImage
MNX_IDMNXM7595 Image of MNXM7595
referencechebi:134001
formulaC15H18NO3
global charge1
mol weight260.313
InChIKeyYJYUDTAJVLORNV-UHFFFAOYSA-O
InChIInChI=1S/C15H17NO3/c17-13-4-1-11(2-5-13)7-8-16-10-12-3-6-14(18)15(19)9-12/h1-6,9,16-19H,7-8,10H2/p+1
SMILESOC1=CC=C(CC[NH2+]CC2=CC(O)=C(O)C=C2)C=C1
MNX internals
InChI (mnx)InChI=1/C15H17NO3/c17-13-4-1-11(2-5-13)7-8-16-10-12-3-6-14(18)15(19)9-12/h1-6,9,16-19H,7-8,10H2 Image of MNXM7595
SMILES (mnx)[CH:1]1=[CH:4][C:13]([OH:17])=[CH:5][CH:2]=[C:11]1[CH2:7][CH2:8][NH:16][CH2:10][C:12]1=[CH:9][C:15]([OH:19])=[C:14]([OH:18])[CH:6]=[CH:3]1
Parent-child relations graph
Occurences in reactions#reac
in my sandbox 0
in MNXref (generic)7
in models (compartimentalized) 0
Similar chemical compounds in external resources
IdentifierDescription

CHEBI:134001
chebi:134001
YJYUDTAJVLORNV-UHFFFAOYSA-O
norbelladine
N-[(3,4-dihydroxyphenyl)methyl]-2-(4-hydroxyphenyl)ethan-1-aminium
norbelladine(1+)

kegg.compound:C16701
keggC:C16701
YJYUDTAJVLORNV-UHFFFAOYSA-N
Norbelladine

seed.compound:cpd16508
seedM:cpd16508
YJYUDTAJVLORNV-UHFFFAOYSA-O
Norbelladine
4-({[2-(4-hydroxyphenyl)ethyl]amino}methyl)benzene-1,2-diol
norbelladine

metacyc.compound:CPD-19420
metacycM:CPD-19420
CHEBI:80666
chebi:80666
YJYUDTAJVLORNV-UHFFFAOYSA-N
norbelladine
4-({[2-(4-hydroxyphenyl)ethyl]amino}methyl)benzene-1,2-diol

keggC:M_C16701
seedM:M_cpd16508
secondary/obsolete/fantasy identifier