Vitas-M small molecule compound
(9R,16S)-4-(acetylamino)-N-[2-(4-methoxyphenyl)ethyl]-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-carboxamide
Catalog ID
STL552231
SMILES COc1ccc(cc1)CCNC(=O)C1Cc2cc(ccc2N2C1[C@@H]1C[C@H](C2)Cn2c1cccc2=O)NC(=O)C
Contact us by email for worldwide delivery information, pricing, and real‑time availability. Send us your quotation request, and we will confirm stock levels, provide exact costs and lead times, suggest alternatives or find analogs when helpful, and share any additional specifications you may need.
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 C31H34N4O4 MW 526.64 g/mol Purity >90% as per NMR
InChI
InChI=1S/C31H34N4O4/c1-19(36)33-23-8-11-27-22(15-23)16-26(31(38)32-13-12-20-6-9-24(39-2)10-7-20)30-25-14-21(18-35(27)30)17-34-28(25)4-3-5-29(34)37/h3-11,15,21,25-26,30H,12-14,16-18H2,1-2H3,(H,32,38)(H,33,36)/t21-,25+,26?,30?/m0/s1InChIKey
JBIRELLIOPGNDL-ARJCIEMNSA-NSynonyms
(1~(S)13~(R))7acetamido~(N)(2(4methoxyphenyl)ethyl)16oxo1115diazapentacyclo(11710^(211)0^(510)0^(1520))henicosa5(10)681719pentaene3carboxamide
(1R9R16S16aR)4acetamidoN(4methoxyphenethyl)12oxo128910121616aoctahydro916methanopyrido(2145)(15)diazocino(12a)quinoline1carboxamide
(9R16S)4(acetylamino)N(2(4methoxyphenyl)ethyl)12oxo1910121616ahexahydro2H8H916methanopyrido(2145)(15)diazocino(12a)quinoline1carboxamide
135640503
COc1ccc(cc1)CCNC(=O)(C@@H)1Cc2cc(ccc2N2(C@@H)1(C@@H)1C(C@H)(C2)Cn2c1cccc2=O)NC(=O)C
InChI=1SC31H34N4O4c119(36)33238112722(1523)1626(31(38)321312206924(392)10720)30251421(1835(27)30)173428(25)43529(34)37h3111521252630H12141618H212H3(H3238)(H3336)t2125+26?30?m0s1
ZINC001547138988
ZINC001547208482
Check stock
See real-time availability and sample size for STL552231 on the Vitas-M platform.
Check stock on Vitas-MAvailable files
Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.