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(S)-5,7-dihydroxy-2-(4-methoxyphenyl)-8-(3-methylbut-2-enyl)chroman-4-one

PropertiesImage
MNX_IDMNXM29396 Image of MNXM29396
referencechebi:70021
formulaC21H22O5
global charge0
mol weight354.402
InChIKeyCTFJUDTWKJHYNX-IBGZPJMESA-N
InChIInChI=1S/C21H22O5/c1-12(2)4-9-15-16(22)10-17(23)20-18(24)11-19(26-21(15)20)13-5-7-14(25-3)8-6-13/h4-8,10,19,22-23H,9,11H2,1-3H3/t19-/m0/s1
SMILESCOC1=CC=C([C@@H]2CC(=O)C3=C(O2)C(CC=C(C)C)=C(O)C=C3O)C=C1
MNX internals
InChI (mnx)InChI=1/C21H22O5/c1-12(2)4-9-15-16(22)10-17(23)20-18(24)11-19(26-21(15)20)13-5-7-14(25-3)8-6-13/h4-8,10,19,22-23H,9,11H2,1-3H3/t19-/m0/s1 Image of MNXM29396
SMILES (mnx)[CH3:1][C:12]([CH3:2])=[CH:4][CH2:9][C:15]1=[C:21]2[C:20](=[C:17]([OH:23])[CH:10]=[C:16]1[OH:22])[C:18](=[O:24])[CH2:11][C@@H:19]([C:13]1=[CH:6][CH:8]=[C:14]([O:25][CH3:3])[CH:7]=[CH:5]1)[O:26]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:70021
chebi:70021
CTFJUDTWKJHYNX-IBGZPJMESA-N 		(S)-5,7-dihydroxy-2-(4-methoxyphenyl)-8-(3-methylbut-2-enyl)chroman-4-one
(2S)-5,7-dihydroxy-2-(4-methoxyphenyl)-8-(3-methylbut-2-en-1-yl)-2,3-dihydro-4H-1-benzopyran-4-one
(2S)-5,7-dihydroxy-4'-methoxy-8-prenylflavanone
4'-O-methyl-8-prenylnaringenin

lipidmaps:LMPK12140343
lipidmapsM:LMPK12140343
CTFJUDTWKJHYNX-UHFFFAOYSA-N 		5,7-Dihydroxy-4'-methoxy-8-C-prenylflavanone

CHEBI:197255
chebi:197255
CTFJUDTWKJHYNX-UHFFFAOYSA-N 		5,7-Dihydroxy-4'-methoxy-8-C-prenylflavanone
5,7-dihydroxy-2-(4-methoxyphenyl)-8-(3-methylbut-2-enyl)-2,3-dihydrochromen-4-one