SE2

3-HYDROXY-2H-CHROMEN-2-ONE

Created:	2013-02-15
Last modified:	2014-09-05

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1 entries where SE2 is found as a standalone ligand1 entries where SE2 is covalently linked to polymer or other heterogen groups

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Chemical Details
Formal Charge	0
Atom Count	18
Chiral Atom Count	0
Bond Count	19
Aromatic Bond Count	6

2D diagram of SE2

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Chemical Component Summary
Name	3-HYDROXY-2H-CHROMEN-2-ONE
Systematic Name (OpenEye OEToolkits)	3-oxidanylchromen-2-one
Formula	C₉ H₆ O₃
Molecular Weight	162.142
Type	NON-POLYMER

Chemical Descriptors
Type	Program	Version	Descriptor
SMILES	ACDLabs	12.01	O=C2Oc1ccccc1C=C2O
SMILES	CACTVS	3.385	OC1=Cc2ccccc2OC1=O
SMILES	OpenEye OEToolkits	1.9.2	c1ccc2c(c1)C=C(C(=O)O2)O
Canonical SMILES	CACTVS	3.385	OC1=Cc2ccccc2OC1=O
Canonical SMILES	OpenEye OEToolkits	1.9.2	c1ccc2c(c1)C=C(C(=O)O2)O
InChI	InChI	1.03	InChI=1S/C9H6O3/c10-7-5-6-3-1-2-4-8(6)12-9(7)11/h1-5,10H
InChIKey	InChI	1.03	MJKVTPMWOKAVMS-UHFFFAOYSA-N

Related Resource References

Resource Name	Reference
Pharos	CHEMBL150372
PubChem	13650
ChEMBL	CHEMBL150372
ChEBI	CHEBI:113542

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