(3aS,4R,7aR)-2-cyclohexyl-6-ethyl-4-(hydroxymethyl)-5-[(Z,1R)-5-(3-hydroxyphenyl)-1-oxidanyl-4-phenyl-pent-4-enyl]-3a,4,7,7a-tetrahydroisoindole-1,3-dione

Systemtic Name: (3aS,4R,7aR)-2-cyclohexyl-6-ethyl-4-(hydroxymethyl)-5-[(Z,1R)-5-(3-hydroxyphenyl)-1-oxidanyl-4-phenyl-pent-4-enyl]-3a,4,7,7a-tetrahydroisoindole-1,3-dione Openeye Name: (3aS,4R,7aR)-2-cyclohexyl-6-ethyl-5-[(Z,1R)-1-hydroxy-5-(3-hydroxyphenyl)-4-phenyl-pent-4-enyl]-4-(hydroxymethyl)-3a,4,7,7a-tetrahydroisoindole-1,3-dione CAS Name: (3aS,4R,7aR)-2-cyclohexyl-6-ethyl-5-[(Z,1R)-1-hydroxy-5-(3-hydroxyphenyl)-4-phenylpent-4-enyl]-4-(hydroxymethyl)-3a,4,7,7a-tetrahydroisoindole-1,3-dione IUPAC Name: (3aS,4R,7aR)-2-cyclohexyl-6-ethyl-5-[(Z,1R)-1-hydroxy-5-(3-hydroxyphenyl)-4-phenylpent-4-enyl]-4-(hydroxymethyl)-3a,4,7,7a-tetrahydroisoindole-1,3-dione Traditional Name: (3aS,4R,7aR)-2-cyclohexyl-6-ethyl-5-[(Z,1R)-1-hydroxy-5-(3-hydroxyphenyl)-4-phenyl-pent-4-enyl]-4-methylol-3a,4,7,7a-tetrahydroisoindole-1,3-quinone Formula: C34H41NO5 MolecularWeight: 543.69304

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C(C2C(C1)C(=O)N(C2=O)C3CCCCC3)CO)C(CCC(=CC4=CC(=CC=C4)O)C5=CC=CC=C5)O

Isomeric SMILES

CCC1=C([C@@H]([C@H]2[C@@H](C1)C(=O)N(C2=O)C3CCCCC3)CO)[C@@H](CC/C(=C/C4=CC(=CC=C4)O)/C5=CC=CC=C5)O

InChI

InChI=1S/C34H41NO5/c1-2-23-20-28-32(34(40)35(33(28)39)26-13-7-4-8-14-26)29(21-36)31(23)30(38)17-16-25(24-11-5-3-6-12-24)18-22-10-9-15-27(37)19-22/h3,5-6,9-12,15,18-19,26,28-30,32,36-38H,2,4,7-8,13-14,16-17,20-21H2,1H3/b25-18-/t28-,29+,30-,32-/m1/s1