Vitas-M small molecule compound
3-benzyl-4,8-dimethyl-2-oxo-2H-chromen-7-yl N-(tert-butoxycarbonyl)-L-alaninate
Catalog ID
STL462422
SMILES O=C(OC(C)(C)C)N[C@H](C(=O)Oc1ccc2c(c1C)oc(=O)c(c2C)Cc1ccccc1)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 C26H29NO6 MW 451.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H29NO6/c1-15-19-12-13-21(31-23(28)17(3)27-25(30)33-26(4,5)6)16(2)22(19)32-24(29)20(15)14-18-10-8-7-9-11-18/h7-13,17H,14H2,1-6H3,(H,27,30)/t17-/m0/s1InChIKey
GPQXSXAILYWGKY-KRWDZBQOSA-NSynonyms
956794-13-1(3BENZYL48DIMETHYL2OXOCHROMEN7YL)(2S)2((2METHYLPROPAN2YL)OXYCARBONYLAMINO)PROPANOATE
(S)3benzyl48dimethyl2oxo2Hchromen7yl2((tertbutoxycarbonyl)amino)propanoate
3benzyl48dimethyl2oxo2Hchromen7ylN(tertbutoxycarbonyl)Lalaninate
956794131
CC1=C(C(=O)OC2=C1C=CC(=C2C)OC(=O)C(C)NC(=O)OC(C)(C)C)CC3=CC=CC=C3
InChI=1SC26H29NO6c11519121321(3123(28)17(3)2725(30)3326(45)6)16(2)22(19)3224(29)20(15)1418108791118h71317H14H216H3(H2730)t17m0s1
O=C(OC(C)(C)C)N(C@H)(C(=O)Oc1ccc2c(c1C)oc(=O)c(c2C)Cc1ccccc1)C
ZINC000002148965
ZINC02148965
ZINC2148965
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