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norspermidine-2,3-dihydroxybenzoate

PropertiesImage
MNX_IDMNXM12484 Image of MNXM12484
referencemetacycM:CPD-11950
formulaC13H23N3O3
global charge2
mol weight269.345
InChIKeyOJLWBCJWELTRCV-UHFFFAOYSA-P
InChIInChI=1S/C13H21N3O3/c14-6-2-7-15-8-3-9-16-13(19)10-4-1-5-11(17)12(10)18/h1,4-5,15,17-18H,2-3,6-9,14H2,(H,16,19)/p+2
SMILES[NH3+]CCC[NH2+]CCCNC(=O)C1=C(O)C(O)=CC=C1
MNX internals
InChI (mnx)InChI=1/C13H21N3O3/c14-6-2-7-15-8-3-9-16-13(19)10-4-1-5-11(17)12(10)18/h1,4-5,15,17-18H,2-3,6-9,14H2,(H,16,19) Image of MNXM12484
SMILES (mnx)[CH:1]1=[CH:4][C:10]([C:13](=[N:16][CH2:9][CH2:3][CH2:8][NH:15][CH2:7][CH2:2][CH2:6][NH2:14])[OH:19])=[C:12]([OH:18])[C:11]([OH:17])=[CH:5]1
Parent-child relations graph
Occurences in reactions#reac
in my sandbox 0
in MNXref (generic)4
in models (compartimentalized) 0
Similar chemical compounds in external resources
IdentifierDescription

metacyc.compound:CPD-11950
metacycM:CPD-11950
OJLWBCJWELTRCV-UHFFFAOYSA-P
norspermidine-2,3-dihydroxybenzoate
DHB-NSPD
N1-(2, 3-dihydroxybenzoyl)norspermidine
NS-DHB

seed.compound:cpd23153
seedM:cpd23153
OJLWBCJWELTRCV-UHFFFAOYSA-P
DHB-NSPD
N1-(2, 3-dihydroxybenzoyl)norspermidine
NS-DHB
norspermidine-2,3-dihydroxybenzoate

seedM:M_cpd23153
secondary/obsolete/fantasy identifier