(2R,6S)-2-azanyl-6-[[(4S)-4-azanyl-5-oxidanyl-5-oxidanylidene-pentanoyl]amino]-7-methoxy-7-oxidanylidene-heptanoic acid

Systemtic Name: (2R,6S)-2-azanyl-6-[[(4S)-4-azanyl-5-oxidanyl-5-oxidanylidene-pentanoyl]amino]-7-methoxy-7-oxidanylidene-heptanoic acid Openeye Name: (2R,6S)-2-amino-6-[[(4S)-4-amino-5-hydroxy-5-oxo-pentanoyl]amino]-7-methoxy-7-oxo-heptanoic acid CAS Name: (2R,6S)-2-amino-6-[[(4S)-4-amino-5-hydroxy-1,5-dioxopentyl]amino]-7-methoxy-7-oxoheptanoic acid IUPAC Name: (2R,6S)-2-amino-6-[[(4S)-4-amino-5-hydroxy-5-oxopentanoyl]amino]-7-methoxy-7-oxoheptanoic acid Traditional Name: (2R,6S)-2-amino-6-[[(4S)-4-amino-5-hydroxy-5-keto-pentanoyl]amino]-7-keto-7-methoxy-enanthic acid Formula: C13H23N3O7 MolecularWeight: 333.33762

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(CCCC(C(=O)O)N)NC(=O)CCC(C(=O)O)N

Isomeric SMILES

COC(=O)[C@H](CCC[C@H](C(=O)O)N)NC(=O)CC[C@@H](C(=O)O)N

InChI

InChI=1S/C13H23N3O7/c1-23-13(22)9(4-2-3-7(14)11(18)19)16-10(17)6-5-8(15)12(20)21/h7-9H,2-6,14-15H2,1H3,(H,16,17)(H,18,19)(H,20,21)/t7-,8+,9+/m1/s1