(2R,3R,4S)-3-acetamido-4-[bis(azanyl)methylideneamino]-2-[(2R,3R,4R)-3,4-bis(oxidanyl)oxepan-2-yl]-3,4-dihydro-2H-pyran-6-carboxylic acid

Systemtic Name: (2R,3R,4S)-3-acetamido-4-[bis(azanyl)methylideneamino]-2-[(2R,3R,4R)-3,4-bis(oxidanyl)oxepan-2-yl]-3,4-dihydro-2H-pyran-6-carboxylic acid Openeye Name: (2R,3R,4S)-3-acetamido-2-[(2R,3R,4R)-3,4-dihydroxyoxepan-2-yl]-4-guanidino-3,4-dihydro-2H-pyran-6-carboxylic acid CAS Name: (2R,3R,4S)-3-acetamido-4-(diaminomethylideneamino)-2-[(2R,3R,4R)-3,4-dihydroxy-2-oxepanyl]-3,4-dihydro-2H-pyran-6-carboxylic acid IUPAC Name: (2R,3R,4S)-3-acetamido-4-(diaminomethylideneamino)-2-[(2R,3R,4R)-3,4-dihydroxyoxepan-2-yl]-3,4-dihydro-2H-pyran-6-carboxylic acid Traditional Name: (2R,3R,4S)-3-acetamido-2-[(2R,3R,4R)-3,4-dihydroxyoxepan-2-yl]-4-guanidino-3,4-dihydro-2H-pyran-6-carboxylic acid Formula: C15H24N4O7 MolecularWeight: 372.37366

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1C(C=C(OC1C2C(C(CCCO2)O)O)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]2[C@@H]([C@@H](CCCO2)O)O)C(=O)O)N=C(N)N

InChI

InChI=1S/C15H24N4O7/c1-6(20)18-10-7(19-15(16)17)5-9(14(23)24)26-12(10)13-11(22)8(21)3-2-4-25-13/h5,7-8,10-13,21-22H,2-4H2,1H3,(H,18,20)(H,23,24)(H4,16,17,19)/t7-,8+,10+,11+,12+,13+/m0/s1