methyl (2S,3S,4R)-2-(1-hydroxyethyl)-3-[(1S,3R,4R,5E,7E)-1-methoxy-3-methyl-4-oxidanyl-9-[[(3R,4Z,6Z,8E)-2,2,4-trimethyl-10-(1,3-oxazol-5-yl)-3-oxidanyl-deca-4,6,8-trienoyl]amino]nona-5,7-dienyl]-1,4-dimethyl-3-oxidanyl-5-oxidanylidene-pyrrolidine-2-carboxylate

Systemtic Name: methyl (2S,3S,4R)-2-(1-hydroxyethyl)-3-[(1S,3R,4R,5E,7E)-1-methoxy-3-methyl-4-oxidanyl-9-[[(3R,4Z,6Z,8E)-2,2,4-trimethyl-10-(1,3-oxazol-5-yl)-3-oxidanyl-deca-4,6,8-trienoyl]amino]nona-5,7-dienyl]-1,4-dimethyl-3-oxidanyl-5-oxidanylidene-pyrrolidine-2-carboxylate Openeye Name: methyl (2S,3S,4R)-3-hydroxy-2-(1-hydroxyethyl)-3-[(1S,3R,4R,5E,7E)-4-hydroxy-9-[[(3R,4Z,6Z,8E)-3-hydroxy-2,2,4-trimethyl-10-oxazol-5-yl-deca-4,6,8-trienoyl]amino]-1-methoxy-3-methyl-nona-5,7-dienyl]-1,4-dimethyl-5-oxo-pyrrolidine-2-carboxylate CAS Name: (2S,3S,4R)-3-hydroxy-2-(1-hydroxyethyl)-3-[(1S,3R,4R,5E,7E)-4-hydroxy-9-[[(3R,4Z,6Z,8E)-3-hydroxy-2,2,4-trimethyl-10-(5-oxazolyl)-1-oxodeca-4,6,8-trienyl]amino]-1-methoxy-3-methylnona-5,7-dienyl]-1,4-dimethyl-5-oxo-2-pyrrolidinecarboxylic acid methyl ester IUPAC Name: methyl (2S,3S,4R)-3-hydroxy-2-(1-hydroxyethyl)-3-[(1S,3R,4R,5E,7E)-4-hydroxy-9-[[(3R,4Z,6Z,8E)-3-hydroxy-2,2,4-trimethyl-10-(1,3-oxazol-5-yl)deca-4,6,8-trienoyl]amino]-1-methoxy-3-methylnona-5,7-dienyl]-1,4-dimethyl-5-oxopyrrolidine-2-carboxylate Traditional Name: (2S,3S,4R)-3-hydroxy-2-(1-hydroxyethyl)-3-[(1S,3R,4R,5E,7E)-4-hydroxy-9-[[(3R,4Z,6Z,8E)-3-hydroxy-2,2,4-trimethyl-10-oxazol-5-yl-deca-4,6,8-trienoyl]amino]-1-methoxy-3-methyl-nona-5,7-dienyl]-5-keto-1,4-dimethyl-pyrrolidine-2-carboxylic acid methyl ester Formula: C37H55N3O10 MolecularWeight: 701.8467

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Descriptors Computed from Structure

Canonical SMILES:

CC1C(=O)N(C(C1(C(CC(C)C(C=CC=CCNC(=O)C(C)(C)C(C(=CC=CC=CCC2=CN=CO2)C)O)O)OC)O)(C(C)O)C(=O)OC)C

Isomeric SMILES

C[C@H]1C(=O)N([C@]([C@@]1([C@H](C[C@@H](C)[C@H](/C=C/C=C/CNC(=O)C(C)(C)[C@@H](/C(=C\C=C/C=C/CC2=CN=CO2)/C)O)O)OC)O)(C(C)O)C(=O)OC)C

InChI

InChI=1S/C37H55N3O10/c1-24(17-13-10-11-14-18-28-22-38-23-50-28)31(43)35(5,6)33(45)39-20-16-12-15-19-29(42)25(2)21-30(48-8)37(47)26(3)32(44)40(7)36(37,27(4)41)34(46)49-9/h10-17,19,22-23,25-27,29-31,41-43,47H,18,20-21H2,1-9H3,(H,39,45)/b13-10-,14-11+,16-12+,19-15+,24-17-/t25-,26+,27?,29+,30+,31-,36-,37-/m1/s1