Vitas-M small molecule compound

(4S,5R,6R)-6-[(1S)-1-hydroxyethyl]-4-methyl-7-oxo-3-({(3S,5S)-5-[(sulfamoylamino)methyl]pyrrolidin-3-yl}sulfanyl)-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylic acid

Catalog ID
STL535645
SMILES C[C@@H]([C@@H]1C(=O)N2[C@H]1[C@H](C)C(=C2C(=O)O)S[C@@H]1CN[C@@H](C1)CNS(=O)(=O)N)O

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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 C15H24N4O6S2 MW 420.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C15H24N4O6S2/c1-6-11-10(7(2)20)14(21)19(11)12(15(22)23)13(6)26-9-3-8(17-5-9)4-18-27(16,24)25/h6-11,17-18,20H,3-5H2,1-2H3,(H,22,23)(H2,16,24,25)/t6-,7-,8-,9-,10-,11-/m0/s1
InChIKey
AVAACINZEOAHHE-PPQVSCAHSA-N
Synonyms

(4~(S)5~(R)6~(R))6((1~(S))1hydroxyethyl)4methyl7oxo3((3~(S)5~(S))5((sulfamoylamino)methyl)pyrrolidin3yl)sulfanyl1azabicyclo(320)hept2ene2carboxylicacid
(4S5R6R)6((1S)1hydroxyethyl)4methyl7oxo3(((3S5S)5((sulfamoylamino)methyl)pyrrolidin3yl)sulfanyl)1azabicyclo(320)hept2ene2carboxylicacid
17571905
InChI=1SC15H24N4O6S2c161110(7(2)20)14(21)19(11)12(15(22)23)13(6)26938(1759)41827(1624)25h611171820H35H212H3(H2223)(H2162425)t67891011m0s1
MFCD09843566
ZINC000013831148
ZINC13831148

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Available files

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