Vitas-M small molecule compound
N-({[3-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-2-methyl-4-oxo-4H-chromen-7-yl]oxy}acetyl)-D-valine
Catalog ID
STK039362
SMILES O=C(N[C@@H](C(=O)O)C(C)C)COc1ccc2c(c1)oc(c(c2=O)c1ccc2c(c1)OCCCO2)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 C26H27NO8 MW 481.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H27NO8/c1-14(2)24(26(30)31)27-22(28)13-34-17-6-7-18-20(12-17)35-15(3)23(25(18)29)16-5-8-19-21(11-16)33-10-4-9-32-19/h5-8,11-12,14,24H,4,9-10,13H2,1-3H3,(H,27,28)(H,30,31)/t24-/m1/s1InChIKey
AJPHCNPBBKICTI-XMMPIXPASA-NSynonyms
956382-98-2(2R)2((2(3(34DIHYDRO2H15BENZODIOXEPIN7YL)2METHYL4OXOCHROMEN7YL)OXYACETYL)AMINO)3METHYLBUTANOICACID
(R)2(2((3(34dihydro2Hbenzo(b)(14)dioxepin7yl)2methyl4oxo4Hchromen7yl)oxy)acetamido)3methylbutanoicacid
956382982
CC1=C(C(=O)C2=C(O1)C=C(C=C2)OCC(=O)NC(C(C)C)C(=O)O)C3=CC4=C(C=C3)OCCCO4
InChI=1SC26H27NO8c114(2)24(26(30)31)2722(28)133417671820(1217)3515(3)23(25(18)29)16581921(1116)3310493219h5811121424H491013H213H3(H2728)(H3031)t24m1s1
MFCD13368323
N(((3(34DIHYDRO2H15BENZODIOXEPIN7YL)2METHYL4OXO4HCHROMEN7YL)OXY)ACETYL)DVALINE
O=C(N(C@@H)(C(=O)O)C(C)C)COc1ccc2c(c1)oc(c(c2=O)c1ccc2c(c1)OCCCO2)C
STK039362
ZINC000002124153
ZINC2124153
Check stock
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Check stock on Vitas-MAvailable files
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