Vitas-M small molecule compound
3-benzyl-4,8-dimethyl-2-oxo-2H-chromen-7-yl N-(tert-butoxycarbonyl)-L-valinate
Catalog ID
STL462360
SMILES O=C(OC(C)(C)C)N[C@H](C(=O)Oc1ccc2c(c1C)oc(=O)c(c2C)Cc1ccccc1)C(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 C28H33NO6 MW 479.57 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H33NO6/c1-16(2)23(29-27(32)35-28(5,6)7)26(31)33-22-14-13-20-17(3)21(15-19-11-9-8-10-12-19)25(30)34-24(20)18(22)4/h8-14,16,23H,15H2,1-7H3,(H,29,32)/t23-/m0/s1InChIKey
WYODQBJQNDCDLS-QHCPKHFHSA-NSynonyms
956194-60-8(3BENZYL48DIMETHYL2OXOCHROMEN7YL)(2S)3METHYL2((2METHYLPROPAN2YL)OXYCARBONYLAMINO)BUTANOATE
(S)3benzyl48dimethyl2oxo2Hchromen7yl2((tertbutoxycarbonyl)amino)3methylbutanoate
3benzyl48dimethyl2oxo2Hchromen7ylN(tertbutoxycarbonyl)Lvalinate
956194608
CC1=C(C(=O)OC2=C1C=CC(=C2C)OC(=O)C(C(C)C)NC(=O)OC(C)(C)C)CC3=CC=CC=C3
InChI=1SC28H33NO6c116(2)23(2927(32)3528(56)7)26(31)332214132017(3)21(15191198101219)25(30)3424(20)18(22)4h8141623H15H217H3(H2932)t23m0s1
O=C(OC(C)(C)C)N(C@H)(C(=O)Oc1ccc2c(c1C)oc(=O)c(c2C)Cc1ccccc1)C(C)C
ZINC000002152080
ZINC02152080
ZINC2152080
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