Vitas-M small molecule compound
Nalpha-[(2S,6'R)-7-chloro-4,6-dimethoxy-6'-methyl-2',3-dioxo-3H-spiro[1-benzofuran-2,1'-cyclohex[3]en]-4'-yl]-N-methyl-D-tryptophanamide
Catalog ID
STL550577
SMILES CNC(=O)[C@@H](Cc1c[nH]c2c1cccc2)NC1=CC(=O)[C@]2([C@@H](C1)C)Oc1c(C2=O)c(OC)cc(c1Cl)OC
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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 C28H28ClN3O6 MW 538.00 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H28ClN3O6/c1-14-9-16(32-19(27(35)30-2)10-15-13-31-18-8-6-5-7-17(15)18)11-22(33)28(14)26(34)23-20(36-3)12-21(37-4)24(29)25(23)38-28/h5-8,11-14,19,31-32H,9-10H2,1-4H3,(H,30,35)/t14-,19-,28+/m1/s1InChIKey
UUDYEZSSGZTVAE-SCVXQASVSA-NSynonyms
(2~(R))2(((2~(S)5~(R))7chloro46dimethoxy5methyl33dioxospiro(1benzofuran24cyclohexene)1yl)amino)3(1~(H)indol3yl)~(N)methylpropanamide
(R)2(((1S6R)7chloro46dimethoxy6methyl23dioxo3Hspiro(benzofuran21cyclohex(3)en)4yl)amino)3(1Hindol3yl)Nmethylpropanamide
127252703
CNC(=O)(C@@H)(Cc1c(nH)c2c1cccc2)NC1=CC(=O)(C@)2((C@@H)(C1)C)Oc1c(C2=O)c(OC)cc(c1Cl)OC
InChI=1SC28H28ClN3O6c114916(3219(27(35)302)1015133118865717(15)18)1122(33)28(14)26(34)2320(363)1221(374)24(29)25(23)3828h581114193132H910H214H3(H3035)t141928+m1s1
Nalpha((2S6R)7chloro46dimethoxy6methyl23dioxo3Hspiro(1benzofuran21cyclohex(3)en)4yl)NmethylDtryptophanamide
ZINC000604405714
ZINC604405714
Check stock
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Check stock on Vitas-MAvailable files
Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.