Vitas-M small molecule compound

N~2~-[3-(6-hydroxy-1,3-benzodioxol-5-yl)-3-(4-methoxyphenyl)propanoyl]-L-isoleucinamide

Catalog ID
STL549660
SMILES CC[C@@H]([C@@H](C(=O)N)NC(=O)CC(c1cc2OCOc2cc1O)c1ccc(cc1)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 C23H28N2O6 MW 428.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H28N2O6/c1-4-13(2)22(23(24)28)25-21(27)10-16(14-5-7-15(29-3)8-6-14)17-9-19-20(11-18(17)26)31-12-30-19/h5-9,11,13,16,22,26H,4,10,12H2,1-3H3,(H2,24,28)(H,25,27)/t13-,16?,22-/m0/s1
InChIKey
IURPNHTULASFDG-UQSKJELJSA-N
Synonyms

(2~(S)3~(S))2((3(6hydroxy13benzodioxol5yl)3(4methoxyphenyl)propanoyl)amino)3methylpentanamide
(2S3S)2(3(6hydroxybenzo(d)(13)dioxol5yl)3(4methoxyphenyl)propanamido)3methylpentanamide
132352289
CC(C@@H)((C@@H)(C(=O)N)NC(=O)CC(c1cc2OCOc2cc1O)c1ccc(cc1)OC)C
InChI=1SC23H28N2O6c1413(2)22(23(24)28)2521(27)1016(145715(293)8614)1791920(1118(17)26)31123019h591113162226H41012H213H3(H22428)(H2527)t1316?22m0s1
N~2~(3(6hydroxy13benzodioxol5yl)3(4methoxyphenyl)propanoyl)Lisoleucinamide
N2(3(6HYDROXY13BENZODIOXOL5YL)3(4METHOXYPHENYL)PROPANOYL)LISOLEUCINAMIDE
ZINC000823491159
ZINC000823491160

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Available files

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