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Citrusinol

PropertiesImage
MNX_IDMNXM47058 Image of MNXM47058
referencechebi:175501
formulaC20H16O6
global charge0
mol weight352.342
InChIKeyOKQQXHUICMLKQI-UHFFFAOYSA-N
InChIInChI=1S/C20H16O6/c1-20(2)8-7-12-14(26-20)9-13(22)15-16(23)17(24)18(25-19(12)15)10-3-5-11(21)6-4-10/h3-9,21-22,24H,1-2H3
SMILESCC1(C)C=CC2=C(C=C(O)C3=C2OC(C2=CC=C(O)C=C2)=C(O)C3=O)O1
MNX internals
InChI (mnx)InChI=1/C20H16O6/c1-20(2)8-7-12-14(26-20)9-13(22)15-16(23)17(24)18(25-19(12)15)10-3-5-11(21)6-4-10/h3-9,21-22,24H,1-2H3 Image of MNXM47058
SMILES (mnx)[CH3:1][C:20]1([CH3:2])[CH:8]=[CH:7][C:12]2=[C:14]([CH:9]=[C:13]([OH:22])[C:15]3=[C:19]2[O:25][C:18]([C:10]2=[CH:4][CH:6]=[C:11]([OH:21])[CH:5]=[CH:3]2)=[C:17]([OH:24])[C:16]3=[O:23])[O:26]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:175501
chebi:175501
OKQQXHUICMLKQI-UHFFFAOYSA-N 		Citrusinol
3,5-dihydroxy-2-(4-hydroxyphenyl)-8,8-dimethylpyrano[2,3-h]chromen-4-one

lipidmaps:LMPK12111994
lipidmapsM:LMPK12111994
OKQQXHUICMLKQI-UHFFFAOYSA-N 		Citrusinol
hmdb:HMDB0037424
OKQQXHUICMLKQI-UHFFFAOYSA-N 		Citrusinol
3,5-Dihydroxy-2-(4-hydroxyphenyl)-8,8-dimethyl-4H,8H-benzo[1,2-b:3,4-b']dipyran-4-one, 9ci
3,5-dihydroxy-2-(4-hydroxyphenyl)-8,8-dimethyl-4H,8H-pyrano[2,3-f]chromen-4-one
citrusinol

hmdb:HMDB37424 		secondary/obsolete/fantasy identifier