5-[[1-[[5-(2,2-dimethyl-1,3-dioxolan-4-yl)-2,2-dimethyl-6-oxidanyl-5,6a-dihydro-3aH-furo[2,3-d][1,3]dioxol-6-yl]oxy]-1-oxidanylidene-3-phenylmethoxy-propan-2-yl]amino]-5-oxidanylidene-2,4-bis(phenylmethyl)pentanoic acid

Systemtic Name: 5-[[1-[[5-(2,2-dimethyl-1,3-dioxolan-4-yl)-2,2-dimethyl-6-oxidanyl-5,6a-dihydro-3aH-furo[2,3-d][1,3]dioxol-6-yl]oxy]-1-oxidanylidene-3-phenylmethoxy-propan-2-yl]amino]-5-oxidanylidene-2,4-bis(phenylmethyl)pentanoic acid Openeye Name: 2,4-dibenzyl-5-[[1-(benzyloxymethyl)-2-[[5-(2,2-dimethyl-1,3-dioxolan-4-yl)-6-hydroxy-2,2-dimethyl-5,6a-dihydro-3aH-furo[2,3-d][1,3]dioxol-6-yl]oxy]-2-oxo-ethyl]amino]-5-oxo-pentanoic acid CAS Name: 5-[[1-[[5-(2,2-dimethyl-1,3-dioxolan-4-yl)-6-hydroxy-2,2-dimethyl-5,6a-dihydro-3aH-furo[2,3-d][1,3]dioxol-6-yl]oxy]-1-oxo-3-phenylmethoxypropan-2-yl]amino]-5-oxo-2,4-bis(phenylmethyl)pentanoic acid IUPAC Name: 2,4-dibenzyl-5-[[1-[[5-(2,2-dimethyl-1,3-dioxolan-4-yl)-6-hydroxy-2,2-dimethyl-5,6a-dihydro-3aH-furo[2,3-d][1,3]dioxol-6-yl]oxy]-1-oxo-3-phenylmethoxypropan-2-yl]amino]-5-oxopentanoic acid Traditional Name: 5-[[1-(benzoxymethyl)-2-[[5-(2,2-dimethyl-1,3-dioxolan-4-yl)-6-hydroxy-2,2-dimethyl-5,6a-dihydro-3aH-furo[2,3-d][1,3]dioxol-6-yl]oxy]-2-keto-ethyl]amino]-2,4-dibenzyl-5-keto-valeric acid Formula: C41H49NO12 MolecularWeight: 747.82726

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Descriptors Computed from Structure

Canonical SMILES:

CC1(OCC(O1)C2C(C3C(O2)OC(O3)(C)C)(O)OC(=O)C(COCC4=CC=CC=C4)NC(=O)C(CC5=CC=CC=C5)CC(CC6=CC=CC=C6)C(=O)O)C

Isomeric SMILES

CC1(OCC(O1)C2C(C3C(O2)OC(O3)(C)C)(O)OC(=O)C(COCC4=CC=CC=C4)NC(=O)C(CC5=CC=CC=C5)CC(CC6=CC=CC=C6)C(=O)O)C

InChI

InChI=1S/C41H49NO12/c1-39(2)49-25-32(51-39)33-41(47,34-38(50-33)54-40(3,4)52-34)53-37(46)31(24-48-23-28-18-12-7-13-19-28)42-35(43)29(20-26-14-8-5-9-15-26)22-30(36(44)45)21-27-16-10-6-11-17-27/h5-19,29-34,38,47H,20-25H2,1-4H3,(H,42,43)(H,44,45)