methyl (3S,4R)-5-methyl-4-[[(2S,3R)-2-[[(2R)-4-methyl-2-[methyl-[(2S)-1-[(2S)-2-oxidanylpropanoyl]pyrrolidin-2-yl]carbonyl-amino]pentanoyl]amino]-3-oxidanyl-butanoyl]amino]-3-oxidanyl-hexanoate

Systemtic Name: methyl (3S,4R)-5-methyl-4-[[(2S,3R)-2-[[(2R)-4-methyl-2-[methyl-[(2S)-1-[(2S)-2-oxidanylpropanoyl]pyrrolidin-2-yl]carbonyl-amino]pentanoyl]amino]-3-oxidanyl-butanoyl]amino]-3-oxidanyl-hexanoate Openeye Name: methyl (3S,4R)-3-hydroxy-4-[[(2S,3R)-3-hydroxy-2-[[(2R)-2-[[(2S)-1-[(2S)-2-hydroxypropanoyl]pyrrolidine-2-carbonyl]-methyl-amino]-4-methyl-pentanoyl]amino]butanoyl]amino]-5-methyl-hexanoate CAS Name: (3S,4R)-3-hydroxy-4-[[(2S,3R)-3-hydroxy-2-[[(2R)-2-[[[(2S)-1-[(2S)-2-hydroxy-1-oxopropyl]-2-pyrrolidinyl]-oxomethyl]-methylamino]-4-methyl-1-oxopentyl]amino]-1-oxobutyl]amino]-5-methylhexanoic acid methyl ester IUPAC Name: methyl (3S,4R)-3-hydroxy-4-[[(2S,3R)-3-hydroxy-2-[[(2R)-2-[[(2S)-1-[(2S)-2-hydroxypropanoyl]pyrrolidine-2-carbonyl]-methylamino]-4-methylpentanoyl]amino]butanoyl]amino]-5-methylhexanoate Traditional Name: (3S,4R)-3-hydroxy-4-[[(2S,3R)-3-hydroxy-2-[[(2R)-2-[[(2S)-1-[(2S)-2-hydroxypropanoyl]prolyl]-methyl-amino]-4-methyl-pentanoyl]amino]butanoyl]amino]-5-methyl-hexanoic acid methyl ester Formula: C27H48N4O9 MolecularWeight: 572.69142

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(=O)NC(C(C)O)C(=O)NC(C(C)C)C(CC(=O)OC)O)N(C)C(=O)C1CCCN1C(=O)C(C)O

Isomeric SMILES

C[C@H]([C@@H](C(=O)N[C@@H]([C@H](CC(=O)OC)O)C(C)C)NC(=O)[C@@H](CC(C)C)N(C)C(=O)[C@@H]1CCCN1C(=O)[C@H](C)O)O

InChI

InChI=1S/C27H48N4O9/c1-14(2)12-19(30(7)27(39)18-10-9-11-31(18)26(38)17(6)33)24(36)29-23(16(5)32)25(37)28-22(15(3)4)20(34)13-21(35)40-8/h14-20,22-23,32-34H,9-13H2,1-8H3,(H,28,37)(H,29,36)/t16-,17+,18+,19-,20+,22-,23+/m1/s1