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broussin

PropertiesImage
MNX_IDMNXM44819 Image of MNXM44819
referencechebi:3185
formulaC16H16O3
global charge0
mol weight256.301
InChIKeyJTPMXGZHRQYFTB-HNNXBMFYSA-N
InChIInChI=1S/C16H16O3/c1-18-14-7-3-11(4-8-14)15-9-5-12-2-6-13(17)10-16(12)19-15/h2-4,6-8,10,15,17H,5,9H2,1H3/t15-/m0/s1
SMILESCOC1=CC=C([C@@H]2CCC3=C(C=C(O)C=C3)O2)C=C1
MNX internals
InChI (mnx)InChI=1/C16H16O3/c1-18-14-7-3-11(4-8-14)15-9-5-12-2-6-13(17)10-16(12)19-15/h2-4,6-8,10,15,17H,5,9H2,1H3/t15-/m0/s1 Image of MNXM44819
SMILES (mnx)[CH3:1][O:18][C:14]1=[CH:8][CH:4]=[C:11]([C@@H:15]2[CH2:9][CH2:5][C:12]3=[C:16]([CH:10]=[C:13]([OH:17])[CH:6]=[CH:2]3)[O:19]2)[CH:3]=[CH:7]1
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:3185
chebi:3185
JTPMXGZHRQYFTB-HNNXBMFYSA-N 		broussin
(2S)-2-(4-methoxyphenyl)-3,4-dihydro-2H-1-benzopyran-7-ol
7-Hydroxy-4'-methoxyflavan

seed.compound:cpd06400
seedM:cpd06400
kegg.compound:C09505
keggC:C09505
lipidmaps:LMPK12020232
lipidmapsM:LMPK12020232
JTPMXGZHRQYFTB-HNNXBMFYSA-N 		Broussin
7-Hydroxy-4'-methoxyflavan

keggC:M_C09505
seedM:M_cpd06400 		secondary/obsolete/fantasy identifier