Vitas-M small molecule compound

ethyl N-[(benzyloxy)carbonyl]alanyl-O-({[N-(tert-butoxycarbonyl)glycyl]amino}acetyl)tyrosinate

Catalog ID
STK368273
SMILES CCOC(=O)C(NC(=O)C(NC(=O)OCc1ccccc1)C)Cc1ccc(cc1)OC(=O)CNC(=O)CNC(=O)OC(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 C31H40N4O10 MW 628.68 g/mol Purity >90% as per NMR
InChI
InChI=1S/C31H40N4O10/c1-6-42-28(39)24(35-27(38)20(2)34-30(41)43-19-22-10-8-7-9-11-22)16-21-12-14-23(15-13-21)44-26(37)18-32-25(36)17-33-29(40)45-31(3,4)5/h7-15,20,24H,6,16-19H2,1-5H3,(H,32,36)(H,33,40)(H,34,41)(H,35,38)
InChIKey
GAGZBZLMVJQLLZ-UHFFFAOYSA-N
Synonyms

CCOC(=O)C(CC1=CC=C(C=C1)OC(=O)CNC(=O)CNC(=O)OC(C)(C)C)NC(=O)C(C)NC(=O)OCC2=CC=CC=C2
ETHYL3(4(2((2((2METHYLPROPAN2YL)OXYCARBONYLAMINO)ACETYL)AMINO)ACETYL)OXYPHENYL)2(2(PHENYLMETHOXYCARBONYLAMINO)PROPANOYLAMINO)PROPANOATE
ETHYL3(4(2(2((TERTBUTOXY)CARBONYLAMINO)ACETYLAMINO)ACETYLOXY)PHENYL)2(2((PHENYLMETHOXY)CARBONYLAMINO)PROPANOYLAMINO)PROPANOATE
ethylN((benzyloxy)carbonyl)alanylO(((N(tertbutoxycarbonyl)glycyl)amino)acetyl)tyrosinate
InChI=1SC31H40N4O10c164228(39)24(3527(38)20(2)3430(41)431922108791122)1621121423(151321)4426(37)183225(36)173329(40)4531(34)5h7152024H61619H215H3(H3236)(H3340)(H3441)(H3538)
MFCD00309187
ZINC000004016484
ZINC000004016487

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.