Vitas-M small molecule compound
N-{[1-(2,3-dihydro-1,4-benzodioxin-6-yl)-5-oxopyrrolidin-3-yl]carbonyl}-L-leucyl-L-alanine
Catalog ID
STL534502
SMILES CC(C[C@@H](C(=O)N[C@H](C(=O)O)C)NC(=O)C1CC(=O)N(C1)c1ccc2c(c1)OCCO2)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 C22H29N3O7 MW 447.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H29N3O7/c1-12(2)8-16(21(28)23-13(3)22(29)30)24-20(27)14-9-19(26)25(11-14)15-4-5-17-18(10-15)32-7-6-31-17/h4-5,10,12-14,16H,6-9,11H2,1-3H3,(H,23,28)(H,24,27)(H,29,30)/t13-,14?,16-/m0/s1InChIKey
UILUHTRFLKAGRC-SFIRGFGWSA-NSynonyms
956929-97-8(2~(S))2(((2~(S))2((1(23dihydro14benzodioxin6yl)5oxopyrrolidine3carbonyl)amino)4methylpentanoyl)amino)propanoicacid
(2S)2((2S)2(1(23dihydrobenzo(b)(14)dioxin6yl)5oxopyrrolidine3carboxamido)4methylpentanamido)propanoicacid
16404474
956929978
CC(C(C@@H)(C(=O)N(C@H)(C(=O)O)C)NC(=O)C1CC(=O)N(C1)c1ccc2c(c1)OCCO2)C
InChI=1SC22H29N3O7c112(2)816(21(28)2313(3)22(29)30)2420(27)14919(26)25(1114)15451718(1015)32763117h4510121416H6911H213H3(H2328)(H2427)(H2930)t1314?16m0s1
MFCD06767202
N((1(23dihydro14benzodioxin6yl)5oxopyrrolidin3yl)carbonyl)LleucylLalanine
ZINC000008790651
ZINC000008790652
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