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N-Methoxyspirobrassinol methyl ether

PropertiesImage
MNX_IDMNXM128490 Image of MNXM128490
referencechebi:169036
formulaC13H16N2O2S2
global charge0
mol weight296.417
InChIKeyKJSKSCBVIGFOKZ-UHFFFAOYSA-N
InChIInChI=1S/C13H16N2O2S2/c1-16-11-13(8-14-12(18-3)19-13)9-6-4-5-7-10(9)15(11)17-2/h4-7,11H,8H2,1-3H3
SMILESCOC1N(OC)C2=C(C=CC=C2)C12CN=C(SC)S2
MNX internals
InChI (mnx)InChI=1/C13H16N2O2S2/c1-16-11-13(8-14-12(18-3)19-13)9-6-4-5-7-10(9)15(11)17-2/h4-7,11H,8H2,1-3H3/t11?,13? Image of MNXM128490
SMILES (mnx)[CH3:1][O:16][CH:11]1[C:13]2([CH2:8][N:14]=[C:12]([S:18][CH3:3])[S:19]2)[C:9]2=[CH:6][CH:4]=[CH:5][CH:7]=[C:10]2[N:15]1[O:17][CH3:2]
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:169036
chebi:169036
KJSKSCBVIGFOKZ-UHFFFAOYSA-N 		N-Methoxyspirobrassinol methyl ether
1,2-dimethoxy-2'-methylsulanylspiro[2H-indole-3,5'-4H-1,3-thiazole]
hmdb:HMDB0041059
KJSKSCBVIGFOKZ-UHFFFAOYSA-N 		N-Methoxyspirobrassinol methyl ether
(-)-1-Methoxyspirobrassinol methyl ether
1,2-Dimethoxy-5'-(methylsulphanyl)-1,2-dihydro-3'H-spiro[indole-3,2'-[1,4]thiazole]
1,2-dimethoxy-5'-(methylsulfanyl)-1,2-dihydro-3'H-spiro[indole-3,2'-[1,4]thiazole]
1,2-dimethoxy-5'-(methylsulfanyl)-2H,3'H-spiro[indole-3,2'-[1,4]thiazole]
1-Methoxyspirobrassinol methyl ether

hmdb:HMDB41059 		secondary/obsolete/fantasy identifier