Vitas-M small molecule compound
(2S,3S)-3-hydroxy-2-((S)-2-((S)-8-methoxy-11b-methyl-1,3-dioxo-5,6-dihydro-1H-imidazo[1',5':1,2]pyrido[3,4-b]indol-2(3H,11H,11bH)-yl)propanamido)butanoic acid
Catalog ID
STL530452
SMILES COc1ccc2c(c1)c1CCN3[C@](c1[nH]2)(C)C(=O)N(C3=O)[C@H](C(=O)N[C@H](C(=O)O)C(O)C)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 C22H26N4O7 MW 458.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H26N4O7/c1-10(18(28)24-16(11(2)27)19(29)30)26-20(31)22(3)17-13(7-8-25(22)21(26)32)14-9-12(33-4)5-6-15(14)23-17/h5-6,9-11,16,23,27H,7-8H2,1-4H3,(H,24,28)(H,29,30)/t10-,11?,16-,22-/m0/s1InChIKey
XIRHHGLOIQTKFM-HIJPHJTRSA-NSynonyms
956948-45-1(2~(S))3hydroxy2(((2~(S))2((2~(S))12methoxy2methyl35dioxo4616triazatetracyclo(7700^(26)0^(1015))hexadeca1(9)10(15)1113tetraen4yl)propanoyl)amino)butanoicacid
(2S3S)3hydroxy2((S)2((S)8methoxy11bmethyl13dioxo56dihydro1Himidazo(1512)pyrido(34b)indol2(3H11H11bH)yl)propanamido)butanoicacid
16402467
956948451
COc1ccc2c(c1)c1CCN3(C@)(c1(nH)2)(C)C(=O)N(C3=O)(C@H)(C(=O)N(C@H)(C(=O)O)C(O)C)C
InChI=1SC22H26N4O7c110(18(28)2416(11(2)27)19(29)30)2620(31)22(3)1713(7825(22)21(26)32)14912(334)5615(14)2317h56911162327H78H214H3(H2428)(H2930)t1011?1622m0s1
MFCD06493713
ZINC000012877274
ZINC000012877285
Check stock
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Check stock on Vitas-MAvailable files
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