(5R,5aR,8aR,9R)-9-oxidanyl-5a-prop-2-enyl-5-(3,4,5-trimethoxyphenyl)-5,8,8a,9-tetrahydro-[2]benzofuro[5,6-f][1,3]benzodioxol-6-one

Systemtic Name: (5R,5aR,8aR,9R)-9-oxidanyl-5a-prop-2-enyl-5-(3,4,5-trimethoxyphenyl)-5,8,8a,9-tetrahydro-[2]benzofuro[5,6-f][1,3]benzodioxol-6-one Openeye Name: (5R,5aR,8aR,9R)-5a-allyl-9-hydroxy-5-(3,4,5-trimethoxyphenyl)-5,8,8a,9-tetrahydroisobenzofuro[5,6-f][1,3]benzodioxol-6-one CAS Name: (5R,5aR,8aR,9R)-9-hydroxy-5a-prop-2-enyl-5-(3,4,5-trimethoxyphenyl)-5,8,8a,9-tetrahydroisobenzofuro[5,6-f][1,3]benzodioxol-6-one IUPAC Name: (5R,5aR,8aR,9R)-9-hydroxy-5a-prop-2-enyl-5-(3,4,5-trimethoxyphenyl)-5,8,8a,9-tetrahydro-[2]benzofuro[5,6-f][1,3]benzodioxol-6-one Traditional Name: (5R,5aR,8aR,9R)-5a-allyl-9-hydroxy-5-(3,4,5-trimethoxyphenyl)-5,8,8a,9-tetrahydroisobenzofuro[5,6-f][1,3]benzodioxol-6-one Formula: C25H26O8 MolecularWeight: 454.46914

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1OC)OC)C2C3=CC4=C(C=C3C(C5C2(C(=O)OC5)CC=C)O)OCO4

Isomeric SMILES

COC1=CC(=CC(=C1OC)OC)[C@@H]2C3=CC4=C(C=C3[C@@H]([C@@H]5[C@@]2(C(=O)OC5)CC=C)O)OCO4

InChI

InChI=1S/C25H26O8/c1-5-6-25-16(11-31-24(25)27)22(26)15-10-18-17(32-12-33-18)9-14(15)21(25)13-7-19(28-2)23(30-4)20(8-13)29-3/h5,7-10,16,21-22,26H,1,6,11-12H2,2-4H3/t16-,21-,22+,25+/m1/s1