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I8L

Summary
Name:(4~{S})-4-oxidanyl-4,6-dihydrofuro[3,2-c]pyran-2-one
Formula:C7 H6 O4
Formal charge:0
Formula weight:154.12 Da
Component type:non-polymer

Chemical Identifiers

ProgramVersionName
OpenEye OEToolkits2.0.7(4~{S})-4-oxidanyl-4,6-dihydrofuro[3,2-c]pyran-2-one

Chemical Descriptors

TypeProgramVersionDescriptor
InChIInChI1.03InChI=1S/C7H6O4/c8-6-3-4-5(11-6)1-2-10-7(4)9/h1,3,7,9H,2H2/t7-/m0/s1
InChIKeyInChI1.03ZRWPUFFVAOMMNM-ZETCQYMHSA-N
SMILES_CANONICALCACTVS3.385O[C@H]1OCC=C2OC(=O)C=C12
SMILESCACTVS3.385O[CH]1OCC=C2OC(=O)C=C12
SMILES_CANONICALOpenEye OEToolkits2.0.7C1C=C2C(=CC(=O)O2)[C@H](O1)O
SMILESOpenEye OEToolkits2.0.7C1C=C2C(=CC(=O)O2)C(O1)O

222415

數據於2024-07-10公開中

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