Vitas-M small molecule compound
N-[(3-hexyl-7-hydroxy-4-methyl-2-oxo-2H-chromen-8-yl)methyl]-L-phenylalanine
Catalog ID
STL460997
SMILES CCCCCCc1c(=O)oc2c(c1C)ccc(c2CN[C@H](C(=O)O)Cc1ccccc1)O
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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 C26H31NO5 MW 437.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H31NO5/c1-3-4-5-9-12-20-17(2)19-13-14-23(28)21(24(19)32-26(20)31)16-27-22(25(29)30)15-18-10-7-6-8-11-18/h6-8,10-11,13-14,22,27-28H,3-5,9,12,15-16H2,1-2H3,(H,29,30)/t22-/m0/s1InChIKey
TVDWNRALLFXSKS-QFIPXVFZSA-NSynonyms
(2S)2((3HEXYL7HYDROXY4METHYL2OXOCHROMEN8YL)METHYLAMINO)3PHENYLPROPANOICACID
(R)2(((3hexyl7hydroxy4methyl2oxo2Hchromen8yl)methyl)amino)3phenylpropanoicacid
CCCCCCC1=C(C2=C(C(=C(C=C2)O)CNC(CC3=CC=CC=C3)C(=O)O)OC1=O)C
CCCCCCc1c(=O)oc2c(c1C)ccc(c2CN(C@@H)(C(=O)O)Cc1ccccc1)O
CCCCCCc1c(=O)oc2c(c1C)ccc(c2CN(C@H)(C(=O)O)Cc1ccccc1)O
InChI=1SC26H31NO5c13459122017(2)19131423(28)21(24(19)3226(20)31)162722(25(29)30)1518107681118h6810111314222728H359121516H212H3(H2930)t22m0s1
MFCD03660365
N((3hexyl7hydroxy4methyl2oxo2Hchromen8yl)methyl)Lphenylalanine
ZINC000011866848
ZINC11866848
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