Vitas-M small molecule compound
N-{[(2S,5R)-3,3-dimethyl-4,4-dioxido-7-oxo-4-thia-1-azabicyclo[3.2.0]hept-2-yl]carbonyl}-L-tryptophan
Catalog ID
STL533674
SMILES OC(=O)[C@H](Cc1c[nH]c2c1cccc2)NC(=O)[C@@H]1N2C(=O)C[C@H]2S(=O)(=O)C1(C)C
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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.
We do not supply quantities above 5 g.
Structure and other identifiers
2D representation rendered from the SMILES, with core physicochemical data.Formula C19H21N3O6S MW 419.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H21N3O6S/c1-19(2)16(22-14(23)8-15(22)29(19,27)28)17(24)21-13(18(25)26)7-10-9-20-12-6-4-3-5-11(10)12/h3-6,9,13,15-16,20H,7-8H2,1-2H3,(H,21,24)(H,25,26)/t13-,15+,16-/m0/s1InChIKey
OWTPIWMLZHECPN-IMJJTQAJSA-NSynonyms
957029-52-6(2~(S))2(((2~(S)5~(R))33dimethyl447trioxo4$l^(6)thia1azabicyclo(320)heptane2carbonyl)amino)3(1~(H)indol3yl)propanoicacid
(S)2((2S5R)33dimethyl44dioxido7oxo4thia1azabicyclo(320)heptane2carboxamido)3(1Hindol3yl)propanoicacid
16404509
957029526
InChI=1SC19H21N3O6Sc119(2)16(2214(23)815(22)29(1927)28)17(24)2113(18(25)26)71092012643511(10)12h36913151620H78H212H3(H2124)(H2526)t1315+16m0s1
N(((2S5R)33dimethyl44dioxido7oxo4thia1azabicyclo(320)hept2yl)carbonyl)Ltryptophan
OC(=O)(C@H)(Cc1c(nH)c2c1cccc2)NC(=O)(C@@H)1N2C(=O)C(C@H)2S(=O)(=O)C1(C)C
ZINC000012884078
ZINC12884078
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