(2S)-2-[2-[(2S,3R,4R,5S,6R)-6-(aminomethyl)-3-[[(2S)-2-azanylpropanoyl]amino]-4,5-bis(oxidanyl)oxan-2-yl]oxyethylamino]-4-methyl-pentanamide

Systemtic Name: (2S)-2-[2-[(2S,3R,4R,5S,6R)-6-(aminomethyl)-3-[[(2S)-2-azanylpropanoyl]amino]-4,5-bis(oxidanyl)oxan-2-yl]oxyethylamino]-4-methyl-pentanamide Openeye Name: (2S)-2-[2-[(2S,3R,4R,5S,6R)-6-(aminomethyl)-3-[[(2S)-2-aminopropanoyl]amino]-4,5-dihydroxy-tetrahydropyran-2-yl]oxyethylamino]-4-methyl-pentanamide CAS Name: (2S)-2-[2-[[(2S,3R,4R,5S,6R)-6-(aminomethyl)-3-[[(2S)-2-amino-1-oxopropyl]amino]-4,5-dihydroxy-2-oxanyl]oxy]ethylamino]-4-methylpentanamide IUPAC Name: (2S)-2-[2-[(2S,3R,4R,5S,6R)-6-(aminomethyl)-3-[[(2S)-2-aminopropanoyl]amino]-4,5-dihydroxyoxan-2-yl]oxyethylamino]-4-methylpentanamide Traditional Name: (2S)-2-[2-[(2S,3R,4R,5S,6R)-6-(aminomethyl)-3-[[(2S)-2-aminopropanoyl]amino]-4,5-dihydroxy-tetrahydropyran-2-yl]oxyethylamino]-4-methyl-valeramide Formula: C17H35N5O6 MolecularWeight: 405.4897

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(=O)N)NCCOC1C(C(C(C(O1)CN)O)O)NC(=O)C(C)N

Isomeric SMILES

C[C@@H](C(=O)N[C@@H]1[C@H]([C@@H]([C@H](O[C@@H]1OCCN[C@@H](CC(C)C)C(=O)N)CN)O)O)N

InChI

InChI=1S/C17H35N5O6/c1-8(2)6-10(15(20)25)21-4-5-27-17-12(22-16(26)9(3)19)14(24)13(23)11(7-18)28-17/h8-14,17,21,23-24H,4-7,18-19H2,1-3H3,(H2,20,25)(H,22,26)/t9-,10-,11+,12+,13+,14+,17-/m0/s1