(4S)-4-(9H-fluoren-9-ylmethoxycarbonylamino)-5-[[(2R)-1-(2-methylpropylamino)-3-oxidanyl-1-oxidanylidene-propan-2-yl]amino]-5-oxidanylidene-pentanoic acid

Systemtic Name: (4S)-4-(9H-fluoren-9-ylmethoxycarbonylamino)-5-[[(2R)-1-(2-methylpropylamino)-3-oxidanyl-1-oxidanylidene-propan-2-yl]amino]-5-oxidanylidene-pentanoic acid Openeye Name: (4S)-4-(9H-fluoren-9-ylmethoxycarbonylamino)-5-[[(1R)-1-(hydroxymethyl)-2-(isobutylamino)-2-oxo-ethyl]amino]-5-oxo-pentanoic acid CAS Name: (4S)-4-[[9H-fluoren-9-ylmethoxy(oxo)methyl]amino]-5-[[(2R)-3-hydroxy-1-(2-methylpropylamino)-1-oxopropan-2-yl]amino]-5-oxopentanoic acid IUPAC Name: (4S)-4-(9H-fluoren-9-ylmethoxycarbonylamino)-5-[[(2R)-3-hydroxy-1-(2-methylpropylamino)-1-oxopropan-2-yl]amino]-5-oxopentanoic acid Traditional Name: (4S)-4-(9H-fluoren-9-ylmethoxycarbonylamino)-5-[[(1R)-2-(isobutylamino)-2-keto-1-methylol-ethyl]amino]-5-keto-valeric acid Formula: C27H33N3O7 MolecularWeight: 511.56682

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CNC(=O)C(CO)NC(=O)C(CCC(=O)O)NC(=O)OCC1C2=CC=CC=C2C3=CC=CC=C13

Isomeric SMILES

CC(C)CNC(=O)[C@@H](CO)NC(=O)[C@H](CCC(=O)O)NC(=O)OCC1C2=CC=CC=C2C3=CC=CC=C13

InChI

InChI=1S/C27H33N3O7/c1-16(2)13-28-25(34)23(14-31)29-26(35)22(11-12-24(32)33)30-27(36)37-15-21-19-9-5-3-7-17(19)18-8-4-6-10-20(18)21/h3-10,16,21-23,31H,11-15H2,1-2H3,(H,28,34)(H,29,35)(H,30,36)(H,32,33)/t22-,23+/m0/s1