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

PropertiesImage
MNX_IDMNXM165449 Image of MNXM165449
referencechebi:152555
formulaC12H14ClO4
global charge-1
mol weight257.693
InChIKeyOTRYFPNTAFPSBU-UHFFFAOYSA-M
InChIInChI=1S/C12H15ClO4/c1-2-3-4-5-7(14)10-8(15)6-9(16)11(13)12(10)17/h6,15-17H,2-5H2,1H3/p-1
SMILESCCCCCC(=O)C1=C(O)C(Cl)=C([O-])C=C1O
MNX internals
InChI (mnx)InChI=1/C12H15ClO4/c1-2-3-4-5-7(14)10-8(15)6-9(16)11(13)12(10)17/h6,15-17H,2-5H2,1H3 Image of MNXM165449
SMILES (mnx)[CH3:1][CH2:2][CH2:3][CH2:4][CH2:5][C:7]([C:10]1=[C:12]([OH:17])[C:11]([Cl:13])=[C:9]([OH:16])[CH:6]=[C:8]1[OH:15])=[O:14]
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:152555
chebi:152555
OTRYFPNTAFPSBU-UHFFFAOYSA-M 		(3-chloro-2,4,6-trihydroxyphenyl)hexan-1-one
(3-chloro-2,4,6-trihydroxyphenyl)hexan-1-one(1-)
2-chloro-4-hexanoyl-3,5-dihydroxyphenolate
Cl-THPH(1-)
chloro-THPH(1-)

CHEBI:153569
chebi:153569
OTRYFPNTAFPSBU-UHFFFAOYSA-N 		(3-chloro-2,4,6-trihydroxyphenyl)hexan-1-one
1-(2,4,6-trihydroxy-3-chlorophenyl)-1-hexanone
1-(3-chloro-2,4,6-trihydroxyphenyl)-1-hexanone
1-(3-chloro-2,4,6-trihydroxyphenyl)hexan-1-one
Cl-THPH
chloro-THPH

sabiork.compound:28888
sabiorkM:28888
OTRYFPNTAFPSBU-UHFFFAOYSA-N 		1-(3-Chloro-2,4,6-trihydroxyphenyl)hexan-1-one
Chloro-THPH