Vitas-M small molecule compound
(1R,9R,16S,16aR)-4-amino-12-oxo-1,9,10,12,16,16a-hexahydro-2H,8H-9,16-methanopyrido[2',1':4,5][1,5]diazocino[1,2-a]quinoline-1-carboxylic acid
Catalog ID
STL551288
SMILES OC(=O)[C@@H]1Cc2cc(N)ccc2N2[C@@H]1[C@@H]1C[C@H](C2)Cn2c1cccc2=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 C20H21N3O3 MW 351.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H21N3O3/c21-13-4-5-16-12(7-13)8-15(20(25)26)19-14-6-11(10-23(16)19)9-22-17(14)2-1-3-18(22)24/h1-5,7,11,14-15,19H,6,8-10,21H2,(H,25,26)/t11-,14+,15+,19+/m0/s1InChIKey
NTHMIGJELLVDOS-GCYOBHRFSA-NSynonyms
2108156-16-5(1~(S)2~(R)3~(R)13~(R))7amino16oxo1115diazapentacyclo(11710^(211)0^(510)0^(1520))henicosa5(10)681719pentaene3carboxylicacid
(1R9R16S16aR)4amino12oxo128910121616aoctahydro916methanopyrido(2145)(15)diazocino(12a)quinoline1carboxylicacid
(1R9R16S16aR)4amino12oxo1910121616ahexahydro2H8H916methanopyrido(2145)(15)diazocino(12a)quinoline1carboxylicacid
125427596
2108156165
InChI=1SC20H21N3O3c2113451612(713)815(20(25)26)1914611(1023(16)19)92217(14)21318(22)24h15711141519H681021H2(H2526)t1114+15+19+m0s1
OC(=O)(C@@H)1Cc2cc(N)ccc2N2(C@@H)1(C@@H)1C(C@H)(C2)Cn2c1cccc2=O
ZINC000524728977
ZINC524728977
Check stock
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