MUX

(4-methyl-2-oxidanylidene-chromen-7-yl) hydrogen sulfate

Created:	2014-02-21
Last modified:	2014-09-05

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1 entries where MUX is found as a standalone ligand

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Chemical Details
Formal Charge	0
Atom Count	25
Chiral Atom Count	0
Bond Count	26
Aromatic Bond Count	6

2D diagram of MUX

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Chemical Component Summary
Name	(4-methyl-2-oxidanylidene-chromen-7-yl) hydrogen sulfate
Systematic Name (OpenEye OEToolkits)	(4-methyl-2-oxidanylidene-chromen-7-yl) hydrogen sulfate
Formula	C₁₀ H₈ O₆ S
Molecular Weight	256.232
Type	NON-POLYMER

Chemical Descriptors
Type	Program	Version	Descriptor
SMILES	ACDLabs	12.01	O=S(=O)(O)Oc2ccc1c(OC(=O)C=C1C)c2
SMILES	CACTVS	3.385	CC1=CC(=O)Oc2cc(O[S](O)(=O)=O)ccc12
SMILES	OpenEye OEToolkits	1.9.2	CC1=CC(=O)Oc2c1ccc(c2)OS(=O)(=O)O
Canonical SMILES	CACTVS	3.385	CC1=CC(=O)Oc2cc(O[S](O)(=O)=O)ccc12
Canonical SMILES	OpenEye OEToolkits	1.9.2	CC1=CC(=O)Oc2c1ccc(c2)OS(=O)(=O)O
InChI	InChI	1.03	InChI=1S/C10H8O6S/c1-6-4-10(11)15-9-5-7(2-3-8(6)9)16-17(12,13)14/h2-5H,1H3,(H,12,13,14)
InChIKey	InChI	1.03	FUYLLJCBCKRIAL-UHFFFAOYSA-N

Related Resource References

Resource Name	Reference
PubChem	84843
ChEMBL	CHEMBL2074784
ChEBI	CHEBI:1905
CCDC/CSD	DEGHON

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