(3R,4R,4aR,11bS)-3,4-bis(oxidanyl)-7-phenylmethoxy-3,4,4a,11b-tetrahydro-[1,3]benzodioxolo[5,6-c]chromen-6-one

Systemtic Name: (3R,4R,4aR,11bS)-3,4-bis(oxidanyl)-7-phenylmethoxy-3,4,4a,11b-tetrahydro-[1,3]benzodioxolo[5,6-c]chromen-6-one Openeye Name: (3R,4R,4aR,11bS)-7-benzyloxy-3,4-dihydroxy-3,4,4a,11b-tetrahydro-[1,3]benzodioxolo[5,6-c]chromen-6-one CAS Name: (3R,4R,4aR,11bS)-3,4-dihydroxy-7-phenylmethoxy-3,4,4a,11b-tetrahydro-[1,3]benzodioxolo[5,6-c][1]benzopyran-6-one IUPAC Name: (3R,4R,4aR,11bS)-3,4-dihydroxy-7-phenylmethoxy-3,4,4a,11b-tetrahydro-[1,3]benzodioxolo[5,6-c]chromen-6-one Traditional Name: (3R,4R,4aR,11bS)-7-benzoxy-3,4-dihydroxy-3,4,4a,11b-tetrahydro-[1,3]benzodioxolo[5,6-c]chromen-6-one Formula: C21H18O7 MolecularWeight: 382.36342

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C(=C3C(=C2)C4C=CC(C(C4OC3=O)O)O)OCC5=CC=CC=C5

Isomeric SMILES

C1OC2=C(O1)C(=C3C(=C2)[C@@H]4C=C[C@H]([C@H]([C@@H]4OC3=O)O)O)OCC5=CC=CC=C5

InChI

InChI=1S/C21H18O7/c22-14-7-6-12-13-8-15-19(27-10-26-15)20(25-9-11-4-2-1-3-5-11)16(13)21(24)28-18(12)17(14)23/h1-8,12,14,17-18,22-23H,9-10H2/t12-,14+,17+,18+/m0/s1