Spectinomycin

AlkaPlorer ID: AK012920

Synonym: 'Actinospectacin', 'spectinomycin', 'Spectinomycin'

IUPAC Name: (5R,8R,11S,12S,13R,14S)-8,12,14-trihydroxy-5-methyl-11,13-bis(methylamino)-2,4,9-trioxatricyclo[8.4.0.03,8]tetradecan-7-one

Structure

SMILES: CN[C@@H]1[C@H](O)[C@H](NC)C2O[C@@]3(O)C(=O)C[C@@H](C)OC3OC2[C@H]1O

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InChI: InChI=1S/C14H24N2O7/c1-5-4-6(17)14(20)13(21-5)22-12-10(19)7(15-2)9(18)8(16-3)11(12)23-14/h5,7-13,15-16,18-20H,4H2,1-3H3/t5-,7-,8+,9+,10+,11?,12?,13?,14+/m1/s1

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InChIKey: UNFWWIHTNXNPBV-HRZOFWKFSA-N

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Source

Properties Information

Molecule Weight: 332.353

TPSA: 129.51

MolLogP: -2.925599999999996

Number of H-Donors: 5

Number of H-Acceptors: 9

RingCount: 3

Activities Information

Organism Target Name Standard Type Standard Value Standard Units doi

Metabolism Information