(4aR)-7-bromanyl-5-methoxy-2,3,4,4a-tetrahydroxanthen-1-one

Systemtic Name: (4aR)-7-bromanyl-5-methoxy-2,3,4,4a-tetrahydroxanthen-1-one Openeye Name: (4aR)-7-bromo-5-methoxy-2,3,4,4a-tetrahydroxanthen-1-one CAS Name: (4aR)-7-bromo-5-methoxy-2,3,4,4a-tetrahydroxanthen-1-one IUPAC Name: (4aR)-7-bromo-5-methoxy-2,3,4,4a-tetrahydroxanthen-1-one Traditional Name: (4aR)-7-bromo-5-methoxy-2,3,4,4a-tetrahydroxanthen-1-one Formula: C14H13BrO3 MolecularWeight: 309.15522

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C2C(=CC(=C1)Br)C=C3C(O2)CCCC3=O

Isomeric SMILES

COC1=C2C(=CC(=C1)Br)C=C3[C@H](O2)CCCC3=O

InChI

InChI=1S/C14H13BrO3/c1-17-13-7-9(15)5-8-6-10-11(16)3-2-4-12(10)18-14(8)13/h5-7,12H,2-4H2,1H3/t12-/m1/s1