Compound - Results

Vancomycin

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Information Structure
Name Vancomycin
Synonyms
(3S-(3R(sup *),6S(sup *)(S(sup *)),7S(sup *),22S(sup *),23R(sup *),26R(sup *),36S:s*,38aS(sup *)))-3-(2-Amino-2-oxoethyl)-44-((2-O-(3-amino-2,3,6-trid
(S(sub A))-(3S,6R,7R,22R,23S,26S,36R,38aR)-44-((2-O-(3-Amino-2,3,6-trideoxy-3-C-methyl-alpha-L-lyxo-hexopyranosyl)-beta-D-glucopyranosyl)oxy)-3-(carba
EINECS 215-772-6
HSDB 3262
Vancocin
Vancomicina
Vancomycin
Vancomycine
Vancomycinum
ATC A07AA09
J01XA01
CID 441141
CAS 001404906
TTD Drug ID DAP001330
SMILES CN[C@H](CC(C)C)C(=O)N[C@@H]1[C@H](O)C2=CC=C(OC3=CC4=CC(OC5=CC=C(C=C5Cl)[C@@H](O)[C@@H]6NC(=O)[C@H](NC(=O)[C@@H]4NC(=O)[C@H](CC(N)=O)NC1=O)C7=CC(=C(O)C=C7)C8=C(C=C(O)C=C8O)[C@H](NC6=O)C(O)=O)=C3O[C@@H]9O[C@H](CO)[C@@H](O)[C@H](O)[C@H]9O[C@H]%10C[C@](C)(N)[C@H](O)[C@H](C)O%10)C(Cl)=C2
Formula C66H75Cl2N9O24
Molweight 1449.25
Atoms 101
LogP 3.9326
Rotatable Bonds 14
H-Bond Donors 0
H-Bond Acceptors 33
Extrarenal fraction 0.05
Elimination half-life 5h