4-(2,2-dimethyl-5-oxidanyl-8-oxidanylidene-6-propanoyl-pyrano[2,3-f]chromen-10-yl)butanoic acid

Systemtic Name: 4-(2,2-dimethyl-5-oxidanyl-8-oxidanylidene-6-propanoyl-pyrano[2,3-f]chromen-10-yl)butanoic acid Openeye Name: 4-(5-hydroxy-2,2-dimethyl-8-oxo-6-propanoyl-pyrano[2,3-f]chromen-10-yl)butanoic acid CAS Name: 4-[5-hydroxy-2,2-dimethyl-8-oxo-6-(1-oxopropyl)-10-pyrano[2,3-f][1]benzopyranyl]butanoic acid IUPAC Name: 4-(5-hydroxy-2,2-dimethyl-8-oxo-6-propanoylpyrano[2,3-f]chromen-10-yl)butanoic acid Traditional Name: 4-(5-hydroxy-8-keto-2,2-dimethyl-6-propionyl-pyrano[2,3-f]chromen-10-yl)butyric acid Formula: C21H22O7 MolecularWeight: 386.39518

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)C1=C(C2=C(C3=C1OC(=O)C=C3CCCC(=O)O)OC(C=C2)(C)C)O

Isomeric SMILES

CCC(=O)C1=C(C2=C(C3=C1OC(=O)C=C3CCCC(=O)O)OC(C=C2)(C)C)O

InChI

InChI=1S/C21H22O7/c1-4-13(22)17-18(26)12-8-9-21(2,3)28-19(12)16-11(6-5-7-14(23)24)10-15(25)27-20(16)17/h8-10,26H,4-7H2,1-3H3,(H,23,24)