(3aS,4R,7aR)-4-(hydroxymethyl)-5-[(1R,4E)-4-[[5-(hydroxymethyl)furan-2-yl]methylidene]-1-oxidanyl-hexyl]-6-methyl-2-phenyl-3a,4,7,7a-tetrahydroisoindole-1,3-dione

Systemtic Name: (3aS,4R,7aR)-4-(hydroxymethyl)-5-[(1R,4E)-4-[[5-(hydroxymethyl)furan-2-yl]methylidene]-1-oxidanyl-hexyl]-6-methyl-2-phenyl-3a,4,7,7a-tetrahydroisoindole-1,3-dione Openeye Name: (3aS,4R,7aR)-5-[(1R,4E)-1-hydroxy-4-[[5-(hydroxymethyl)-2-furyl]methylene]hexyl]-4-(hydroxymethyl)-6-methyl-2-phenyl-3a,4,7,7a-tetrahydroisoindole-1,3-dione CAS Name: (3aS,4R,7aR)-5-[(1R,4E)-1-hydroxy-4-[[5-(hydroxymethyl)-2-furanyl]methylidene]hexyl]-4-(hydroxymethyl)-6-methyl-2-phenyl-3a,4,7,7a-tetrahydroisoindole-1,3-dione IUPAC Name: (3aS,4R,7aR)-5-[(1R,4E)-1-hydroxy-4-[[5-(hydroxymethyl)furan-2-yl]methylidene]hexyl]-4-(hydroxymethyl)-6-methyl-2-phenyl-3a,4,7,7a-tetrahydroisoindole-1,3-dione Traditional Name: (3aS,4R,7aR)-5-[(E,1R)-4-ethyl-1-hydroxy-5-(5-methylol-2-furyl)pent-4-enyl]-6-methyl-4-methylol-2-phenyl-3a,4,7,7a-tetrahydroisoindole-1,3-quinone Formula: C28H33NO6 MolecularWeight: 479.56472

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=CC1=CC=C(O1)CO)CCC(C2=C(CC3C(C2CO)C(=O)N(C3=O)C4=CC=CC=C4)C)O

Isomeric SMILES

CC/C(=C\C1=CC=C(O1)CO)/CC[C@H](C2=C(C[C@@H]3[C@H]([C@H]2CO)C(=O)N(C3=O)C4=CC=CC=C4)C)O

InChI

InChI=1S/C28H33NO6/c1-3-18(14-20-10-11-21(15-30)35-20)9-12-24(32)25-17(2)13-22-26(23(25)16-31)28(34)29(27(22)33)19-7-5-4-6-8-19/h4-8,10-11,14,22-24,26,30-32H,3,9,12-13,15-16H2,1-2H3/b18-14+/t22-,23+,24-,26-/m1/s1