Vitas-M small molecule compound
N~3~-{3-[(2S,6'R)-7-chloro-2'-hydroxy-4,6-dimethoxy-6'-methyl-3,4'-dioxo-3H-spiro[1-benzofuran-2,1'-cyclohex[2]en]-3'-yl]-3-(4-hydroxy-3-methoxyphenyl)propanoyl}-N-pyridin-2-yl-beta-alaninamide
Catalog ID
STL552498
SMILES COc1cc(ccc1O)C(C1=C(O)[C@]2([C@@H](CC1=O)C)Oc1c(C2=O)c(OC)cc(c1Cl)OC)CC(=O)NCCC(=O)Nc1ccccn1
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 C34H34ClN3O10 MW 680.11 g/mol Purity >90% as per NMR
InChI
InChI=1S/C34H34ClN3O10/c1-17-13-21(40)28(32(43)34(17)33(44)29-23(46-3)16-24(47-4)30(35)31(29)48-34)19(18-8-9-20(39)22(14-18)45-2)15-27(42)37-12-10-26(41)38-25-7-5-6-11-36-25/h5-9,11,14,16-17,19,39,43H,10,12-13,15H2,1-4H3,(H,37,42)(H,36,38,41)/t17-,19?,34+InChIKey
WBZTZOUPFZNTRM-FQAVJONQSA-NSynonyms
132351901
3((1S6R)7chloro2hydroxy46dimethoxy6methyl34dioxo3Hspiro(benzofuran21cyclohex(2)en)3yl)3(4hydroxy3methoxyphenyl)N(3oxo3(pyridin2ylamino)propyl)propanamide
3((2~(S)4~(R))7chloro2hydroxy46dimethoxy4methyl36dioxospiro(1benzofuran23cyclohexene)1yl)3(4hydroxy3methoxyphenyl)~(N)(3oxo3(pyridin2ylamino)propyl)propanamide
COc1cc(ccc1O)C(C1=C(O)(C@)2((C@@H)(CC1=O)C)Oc1c(C2=O)c(OC)cc(c1Cl)OC)CC(=O)NCCC(=O)Nc1ccccn1
InChI=1SC34H34ClN3O10c1171321(40)28(32(43)34(17)33(44)2923(463)1624(474)30(35)31(29)4834)19(188920(39)22(1418)452)1527(42)37121026(41)3825756113625h5911141617193943H10121315H214H3(H3742)(H363841)t1719?34+m1s1
N~3~(3((2S6R)7chloro2hydroxy46dimethoxy6methyl34dioxo3Hspiro(1benzofuran21cyclohex(2)en)3yl)3(4hydroxy3methoxyphenyl)propanoyl)Npyridin2ylbetaalaninamide
N3(3((2S6R)7CHLORO2HYDROXY46DIMETHOXY6METHYL34DIOXO3HSPIRO(1BENZOFURAN21CYCLOHEX(2)EN)3YL)3(4HYDROXY3METHOXYPHENYL)PROPANOYL)NPYRIDIN2YLBETAALANINAMIDE
ZINC000824596480
ZINC000824596481
Check stock
See real-time availability and sample size for STL552498 on the Vitas-M platform.
Check stock on Vitas-MAvailable files
Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.