Vitas-M small molecule compound
N~2~-[(2S,6'R)-7-chloro-4,6-dimethoxy-6'-methyl-2',3-dioxo-3H-spiro[1-benzofuran-2,1'-cyclohex[3]en]-4'-yl]-L-isoleucinamide
Catalog ID
STL550554
SMILES CC[C@@H]([C@@H](C(=O)N)NC1=CC(=O)[C@]2([C@@H](C1)C)Oc1c(C2=O)c(OC)cc(c1Cl)OC)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 C22H27ClN2O6 MW 450.92 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H27ClN2O6/c1-6-10(2)18(21(24)28)25-12-7-11(3)22(15(26)8-12)20(27)16-13(29-4)9-14(30-5)17(23)19(16)31-22/h8-11,18,25H,6-7H2,1-5H3,(H2,24,28)/t10-,11+,18-,22-/m0/s1InChIKey
DYKNMDZKBYNCEH-ZRXHZUQLSA-NSynonyms
(2~(S)3~(S))2(((2~(S)5~(R))7chloro46dimethoxy5methyl33dioxospiro(1benzofuran24cyclohexene)1yl)amino)3methylpentanamide
(2S3S)2(((1S6R)7chloro46dimethoxy6methyl23dioxo3Hspiro(benzofuran21cyclohex(3)en)4yl)amino)3methylpentanamide
127253815
CC(C@@H)((C@@H)(C(=O)N)NC1=CC(=O)(C@)2((C@@H)(C1)C)Oc1c(C2=O)c(OC)cc(c1Cl)OC)C
InChI=1SC22H27ClN2O6c1610(2)18(21(24)28)2512711(3)22(15(26)812)20(27)1613(294)914(305)17(23)19(16)3122h8111825H67H215H3(H22428)t1011+1822m0s1
N~2~((2S6R)7chloro46dimethoxy6methyl23dioxo3Hspiro(1benzofuran21cyclohex(3)en)4yl)Lisoleucinamide
N2((2S6R)7CHLORO46DIMETHOXY6METHYL23DIOXO3HSPIRO(1BENZOFURAN21CYCLOHEX(3)EN)4YL)LISOLEUCINAMIDE
ZINC000604403929
ZINC604403929
Check stock
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Check stock on Vitas-MAvailable files
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