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dihydrogeodin

PropertiesImage
MNX_IDMNXM97507 Image of MNXM97507
referencechebi:150012
formulaC17H12Cl2O7
global charge-2
mol weight399.182
InChIKeyAXIPUIQLQUNOCF-UHFFFAOYSA-L
InChIInChI=1S/C17H14Cl2O7/c1-6-12(18)15(22)11(16(23)13(6)19)14(21)10-8(17(24)26-3)4-7(20)5-9(10)25-2/h4-5,20,22-23H,1-3H3/p-2
SMILESCOC(=O)C1=CC(O)=CC(OC)=C1C(=O)C1=C([O-])C(Cl)=C(C)C(Cl)=C1[O-]
MNX internals
InChI (mnx)InChI=1/C17H14Cl2O7/c1-6-12(18)15(22)11(16(23)13(6)19)14(21)10-8(17(24)26-3)4-7(20)5-9(10)25-2/h4-5,20,22-23H,1-3H3 Image of MNXM97507
SMILES (mnx)[CH3:1][C:6]1=[C:12]([Cl:18])[C:15]([OH:22])=[C:11]([C:14]([C:10]2=[C:8]([C:17](=[O:24])[O:26][CH3:3])[CH:4]=[C:7]([OH:20])[CH:5]=[C:9]2[O:25][CH3:2])=[O:21])[C:16]([OH:23])=[C:13]1[Cl:19]
Parent-child relations graph
Occurences in reactions#reac
in my sandbox 0
in MNXref (generic)4
in models (compartimentalized) 0
Similar chemical compounds in external resources
IdentifierDescription

CHEBI:150012
chebi:150012
AXIPUIQLQUNOCF-UHFFFAOYSA-L 		dihydrogeodin
4,6-dichloro-2-[4-hydroxy-2-methoxy-6-(methoxycarbonyl)benzoyl]-5-methylbenzene-1,3-bis(olate)
dihydrogeodin dianion
dihydrogeodin(2-)

metacyc.compound:CPD-14537
metacycM:CPD-14537
seed.compound:cpd34029
seedM:cpd34029
AXIPUIQLQUNOCF-UHFFFAOYSA-M 		dihydrogeodin

CHEBI:155891
chebi:155891
AXIPUIQLQUNOCF-UHFFFAOYSA-N 		dihydrogeodin
2-(3,5-dichloro-2,6-dihydroxy-4-methylbenzoyl)-5-hydroxy-3-methoxybenzoic acid methyl ester
2-[2,6-dihydroxy-3,5-dichloro-4-methylbenzoyl]-3-methoxy-5-hydroxybenzoic acid methyl ester
methyl 2-(3,5-dichloro-2,6-dihydroxy-4-methylbenzoyl)-5-hydroxy-3-methoxybenzoate

seedM:M_cpd34029 		secondary/obsolete/fantasy identifier