Albothricin

AlkaPlorer ID: AK075828

Synonym: None

IUPAC Name: [(2S,3S,4R,5R,6R)-6-[[(3aR,7aR)-5-methyl-4-oxo-3a,6,7,7a-tetrahydro-1H-imidazo[4,5-c]pyridin-2-yl]amino]-5-[[(3S)-3,6-diaminohexanoyl]amino]-4-hydroxy-2-(hydroxymethyl)oxan-3-yl] carbamate

Structure

SMILES: CN1CC[C@H]2N=C(N[C@@H]3O[C@@H](CO)[C@@H](OC(=N)O)[C@H](O)[C@H]3N=C(O)C[C@@H](N)CCCN)N[C@H]2C1=O

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InChI: InChI=1S/C20H36N8O7/c1-28-6-4-10-13(18(28)32)26-20(24-10)27-17-14(25-12(30)7-9(22)3-2-5-21)15(31)16(35-19(23)33)11(8-29)34-17/h9-11,13-17,29,31H,2-8,21-22H2,1H3,(H2,23,33)(H,25,30)(H2,24,26,27)/t9-,10+,11-,13+,14+,15+,16+,17+/m0/s1

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InChIKey: OMOKIMHQSCTDRA-HOOARHKFSA-N

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Source

Properties Information

Molecule Weight: 500.5570000000003

TPSA: 244.36

MolLogP: -3.128029999999992

Number of H-Donors: 9

Number of H-Acceptors: 12

RingCount: 3

Activities Information

Organism Target Name Standard Type Standard Value Standard Units doi

Metabolism Information