Antibiotic LL-BM 27β; 2-Deoxy

AlkaPlorer ID: AK118277

Synonym: Antibiotic NK 1001, NK 1001

IUPAC Name: 2-(aminomethyl)-6-[4,6-diamino-2-hydroxy-3-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxycyclohexyl]oxyoxane-3,4,5-triol

Structure

SMILES: NCC1OC(OC2C(N)CC(N)C(OC3OC(CO)C(O)C(O)C3O)C2O)C(O)C(O)C1O

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InChI: InChI=1S/C18H35N3O12/c19-2-6-8(23)10(25)12(27)17(30-6)32-15-4(20)1-5(21)16(14(15)29)33-18-13(28)11(26)9(24)7(3-22)31-18/h4-18,22-29H,1-3,19-21H2

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InChIKey: NZCOZAMBHLSNDW-UHFFFAOYSA-N

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Reference

PubChem CID: 78052415

COCONUT: CNP0176407

Properties Information

Molecule Weight: 485.4870000000001

TPSA: 276.82

MolLogP: -7.257799999999995

Number of H-Donors: 11

Number of H-Acceptors: 15

RingCount: 3

Activities Information

Organism Target Name Standard Type Standard Value Standard Units doi

Metabolism Information