Compound Selection

Formula: C29H55N5O18

MW: 761.78

Salt: H2SO4

CAS: 54911-32-9

TNP NUMBER: TNP00611

MDL NUMBER: MFCD09788234

IUPAC: 2-[5-amino-2-(aminomethyl)-6-(5-{3,5-diamino-6-[3-amino-5-hydroxy-6-(hydroxyme thyl)(2H-3,4,5,6-tetrahydropyran-2-yloxy)]-2-hydroxycyclohexyloxy}-4-hydroxy-2 -(hydroxymethyl)oxolan-3-yloxy)-4-hydroxy(2H-3,4,5,6-tetrahydropyran-3-yloxy)] -6-(hydroxymethyl)

Smiles: O(C1C(C(OC2C(C(C(OC3C(C(C(O)C(O3)CO)O)O)C(O2)CN)O)N)C(O1)CO)O)C1C(OC2OC(CO)C(CC2N)O)C(N)CC(C1O)N

Produced by Actinomycetes, Streptomyces lividus; Antibiotic agent

THERAPEUTIC CATEGORY: Antibacterial

ACCEPTORS: 18

DONORS: 20

ROTATION BONDS: 22

N+O: 23

Chiral Centers: 23

LogP: -15.1

LogS: 0.36

LIPINSKI: 1

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MyriaScreen II – diversity screening library from Sigma-Aldrich and TimTec
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