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(3,5-dichloro-2,4,6-trihydroxyphenyl)hexan-1-one

PropertiesImage
MNX_IDMNXM162874 Image of MNXM162874
referencechebi:90398
formulaC12H13Cl2O4
global charge-1
mol weight292.138
InChIKeyWLWLDMLTAFSEDI-UHFFFAOYSA-M
InChIInChI=1S/C12H14Cl2O4/c1-2-3-4-5-6(15)7-10(16)8(13)12(18)9(14)11(7)17/h16-18H,2-5H2,1H3/p-1
SMILESCCCCCC(=O)C1=C(O)C(Cl)=C([O-])C(Cl)=C1O
MNX internals
InChI (mnx)InChI=1/C12H14Cl2O4/c1-2-3-4-5-6(15)7-10(16)8(13)12(18)9(14)11(7)17/h16-18H,2-5H2,1H3 Image of MNXM162874
SMILES (mnx)[CH3:1][CH2:2][CH2:3][CH2:4][CH2:5][C:6]([C:7]1=[C:10]([OH:16])[C:8]([Cl:13])=[C:12]([OH:18])[C:9]([Cl:14])=[C:11]1[OH:17])=[O:15]
Parent-child relations graph
Occurences in reactions#reac
in my sandbox 0
in MNXref (generic)3
in models (compartimentalized) 2
Similar chemical compounds in external resources
IdentifierDescription

CHEBI:90398
chebi:90398
WLWLDMLTAFSEDI-UHFFFAOYSA-M 		(3,5-dichloro-2,4,6-trihydroxyphenyl)hexan-1-one
(3,5-dichloro-2,4,6-trihydroxyphenyl)hexan-1-one(1-)
2,6-dichloro-4-hexanoyl-3,5-dihydroxyphenolate
3,5-dichloro-THPH(1-)
Cl2-THPH(1-)
dichloro-THPH(1-)

CHEBI:90396
chebi:90396
WLWLDMLTAFSEDI-UHFFFAOYSA-N 		(3,5-dichloro-2,4,6-trihydroxyphenyl)hexan-1-one
1-(3,5-dichloro-2,4,6-trihydroxyphenyl)hexan-1-one
3,5-dichloro-THPH
Cl2-THPH
dichloro-THPH

sabiork.compound:28890
sabiorkM:28890
WLWLDMLTAFSEDI-UHFFFAOYSA-N 		1-(3,5-Dichloro-2,4,6-trihydroxyphenyl)hexan-1-one
Dichloro-THPH