oxan-2-ylmethyl N-[(5S,5aS,8aR,9R)-9-(3,5-dimethoxy-4-oxidanyl-phenyl)-8-oxidanylidene-5a,6,8a,9-tetrahydro-5H-[2]benzofuro[5,6-f][1,3]benzodioxol-5-yl]carbamate

Systemtic Name: oxan-2-ylmethyl N-[(5S,5aS,8aR,9R)-9-(3,5-dimethoxy-4-oxidanyl-phenyl)-8-oxidanylidene-5a,6,8a,9-tetrahydro-5H-[2]benzofuro[5,6-f][1,3]benzodioxol-5-yl]carbamate Openeye Name: tetrahydropyran-2-ylmethyl N-[(5S,5aS,8aR,9R)-9-(4-hydroxy-3,5-dimethoxy-phenyl)-8-oxo-5a,6,8a,9-tetrahydro-5H-isobenzofuro[5,6-f][1,3]benzodioxol-5-yl]carbamate CAS Name: N-[(5S,5aS,8aR,9R)-9-(4-hydroxy-3,5-dimethoxyphenyl)-8-oxo-5a,6,8a,9-tetrahydro-5H-isobenzofuro[5,6-f][1,3]benzodioxol-5-yl]carbamic acid 2-oxanylmethyl ester IUPAC Name: oxan-2-ylmethyl N-[(5S,5aS,8aR,9R)-9-(4-hydroxy-3,5-dimethoxyphenyl)-8-oxo-5a,6,8a,9-tetrahydro-5H-[2]benzofuro[5,6-f][1,3]benzodioxol-5-yl]carbamate Traditional Name: N-[(5S,5aS,8aR,9R)-9-(4-hydroxy-3,5-dimethoxy-phenyl)-8-keto-5a,6,8a,9-tetrahydro-5H-isobenzofuro[5,6-f][1,3]benzodioxol-5-yl]carbamic acid tetrahydropyran-2-ylmethyl ester Formula: C28H31NO10 MolecularWeight: 541.54644

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1O)OC)C2C3C(COC3=O)C(C4=CC5=C(C=C24)OCO5)NC(=O)OCC6CCCCO6

Isomeric SMILES

COC1=CC(=CC(=C1O)OC)[C@H]2[C@@H]3[C@H](COC3=O)[C@@H](C4=CC5=C(C=C24)OCO5)NC(=O)OCC6CCCCO6

InChI

InChI=1S/C28H31NO10/c1-33-21-7-14(8-22(34-2)26(21)30)23-16-9-19-20(39-13-38-19)10-17(16)25(18-12-36-27(31)24(18)23)29-28(32)37-11-15-5-3-4-6-35-15/h7-10,15,18,23-25,30H,3-6,11-13H2,1-2H3,(H,29,32)/t15?,18-,23+,24-,25+/m0/s1