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brassinin

MNXM44673 is deprecated and replaced by MNXM1100638
PropertiesImage
MNX_IDMNXM1100638 Image of MNXM1100638
referencechebi:38119
formulaC11H12N2S2
global charge0
mol weight236.365
InChIKeyQYKQWFZDEDFELK-UHFFFAOYSA-N
InChIInChI=1S/C11H12N2S2/c1-15-11(14)13-7-8-6-12-10-5-3-2-4-9(8)10/h2-6,12H,7H2,1H3,(H,13,14)
SMILESCSC(=S)NCC1=CNC2=C1C=CC=C2
MNX internals
InChI (mnx)InChI=1/C11H12N2S2/c1-15-11(14)13-7-8-6-12-10-5-3-2-4-9(8)10/h2-6,12H,7H2,1H3,(H,13,14) Image of MNXM1100638
SMILES (mnx)[CH3:1][S:15][C:11](=[N:13][CH2:7][C:8]1=[CH:6][NH:12][C:10]2=[CH:5][CH:3]=[CH:2][CH:4]=[C:9]12)[SH:14]
Parent-child relations graph
Occurences in reactions#reac
in my sandbox 0
in MNXref (generic)1
in models (compartimentalized) 0
Similar chemical compounds in external resources
IdentifierDescription

CHEBI:38119
chebi:38119
QYKQWFZDEDFELK-UHFFFAOYSA-N 		brassinin
Brassinine
methyl (1H-indol-3-ylmethyl)carbamodithioate
methyl (1H-indol-3-ylmethyl)dithiocarbamate
hmdb:HMDB0033350
QYKQWFZDEDFELK-UHFFFAOYSA-N 		Brassinin
Brassinin, 1
Brassinine
Carbamodithioic acid, (1H-indol-3-ylmethyl)-, methyl ester
Methyl (1H-indol-3-ylmethyl)carbamodithioate
Methyl (1H-indol-3-ylmethyl)carbamodithioate, 9ci
Methyl (1H-indol-3-ylmethyl)dithiocarbamate
Methyl (1H-indol-3-ylmethyl)dithiocarbamic acid
N-(1H-indol-3-ylmethyl)(methylsulfanyl)carbothioamide
brassinin

metacyc.compound:CPD-19510
metacycM:CPD-19510
seed.compound:cpd33403
seedM:cpd33403
QYKQWFZDEDFELK-UHFFFAOYSA-N 		brassinin

hmdb:HMDB33350
seedM:M_cpd33403 		secondary/obsolete/fantasy identifier