(2R,3R,4S)-3-acetamido-4-[bis(azanyl)methylideneamino]-2-[(1R,2R)-2,3-bis(oxidanyl)-1-(10-oxidanyldecoxy)propyl]-3,4-dihydro-2H-pyran-6-carboxylic acid

Systemtic Name: (2R,3R,4S)-3-acetamido-4-[bis(azanyl)methylideneamino]-2-[(1R,2R)-2,3-bis(oxidanyl)-1-(10-oxidanyldecoxy)propyl]-3,4-dihydro-2H-pyran-6-carboxylic acid Openeye Name: (2R,3R,4S)-3-acetamido-2-[(1R,2R)-2,3-dihydroxy-1-(10-hydroxydecoxy)propyl]-4-guanidino-3,4-dihydro-2H-pyran-6-carboxylic acid CAS Name: (2R,3R,4S)-3-acetamido-4-(diaminomethylideneamino)-2-[(1R,2R)-2,3-dihydroxy-1-(10-hydroxydecoxy)propyl]-3,4-dihydro-2H-pyran-6-carboxylic acid IUPAC Name: (2R,3R,4S)-3-acetamido-4-(diaminomethylideneamino)-2-[(1R,2R)-2,3-dihydroxy-1-(10-hydroxydecoxy)propyl]-3,4-dihydro-2H-pyran-6-carboxylic acid Traditional Name: (2R,3R,4S)-3-acetamido-2-[(1R,2R)-2,3-dihydroxy-1-(10-hydroxydecoxy)propyl]-4-guanidino-3,4-dihydro-2H-pyran-6-carboxylic acid Formula: C22H40N4O8 MolecularWeight: 488.575

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1C(C=C(OC1C(C(CO)O)OCCCCCCCCCCO)C(=O)O)N=C(N)N

Isomeric SMILES

CC(=O)N[C@@H]1[C@H](C=C(O[C@H]1[C@@H]([C@@H](CO)O)OCCCCCCCCCCO)C(=O)O)N=C(N)N

InChI

InChI=1S/C22H40N4O8/c1-14(29)25-18-15(26-22(23)24)12-17(21(31)32)34-20(18)19(16(30)13-28)33-11-9-7-5-3-2-4-6-8-10-27/h12,15-16,18-20,27-28,30H,2-11,13H2,1H3,(H,25,29)(H,31,32)(H4,23,24,26)/t15-,16+,18+,19+,20+/m0/s1