(3S,4R)-3-bromanyl-5-methoxy-2,2-dimethyl-4-oxidanyl-3,4-dihydropyrano[3,2-b]xanthen-6-one

Systemtic Name: (3S,4R)-3-bromanyl-5-methoxy-2,2-dimethyl-4-oxidanyl-3,4-dihydropyrano[3,2-b]xanthen-6-one Openeye Name: (3S,4R)-3-bromo-4-hydroxy-5-methoxy-2,2-dimethyl-3,4-dihydropyrano[3,2-b]xanthen-6-one CAS Name: (3S,4R)-3-bromo-4-hydroxy-5-methoxy-2,2-dimethyl-3,4-dihydropyrano[3,2-b]xanthen-6-one IUPAC Name: (3S,4R)-3-bromo-4-hydroxy-5-methoxy-2,2-dimethyl-3,4-dihydropyrano[3,2-b]xanthen-6-one Traditional Name: (3S,4R)-3-bromo-4-hydroxy-5-methoxy-2,2-dimethyl-3,4-dihydropyrano[3,2-b]xanthen-6-one Formula: C19H17BrO5 MolecularWeight: 405.23928

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C(C(C2=C(O1)C=C3C(=C2OC)C(=O)C4=CC=CC=C4O3)O)Br)C

Isomeric SMILES

CC1([C@H]([C@@H](C2=C(O1)C=C3C(=C2OC)C(=O)C4=CC=CC=C4O3)O)Br)C

InChI

InChI=1S/C19H17BrO5/c1-19(2)18(20)16(22)14-12(25-19)8-11-13(17(14)23-3)15(21)9-6-4-5-7-10(9)24-11/h4-8,16,18,22H,1-3H3/t16-,18+/m1/s1