Vitas-M small molecule compound

methyl N-{[4-(3-methylbutoxy)phenyl]carbonyl}tyrosinate

Catalog ID
STK685492
SMILES COC(=O)C(NC(=O)c1ccc(cc1)OCCC(C)C)Cc1ccc(cc1)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 C22H27NO5 MW 385.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H27NO5/c1-15(2)12-13-28-19-10-6-17(7-11-19)21(25)23-20(22(26)27-3)14-16-4-8-18(24)9-5-16/h4-11,15,20,24H,12-14H2,1-3H3,(H,23,25)
InChIKey
CHZMNFRYVUPGRW-UHFFFAOYSA-N
Synonyms
1009240-19-0
1009240190
BENZENEPROPANOICACID4HYDROXYALPHA((4(3METHYLBUTOXY)BENZOYL)AMINO)METHYLESTER
CC(C)CCOC1=CC=C(C=C1)C(=O)NC(CC2=CC=C(C=C2)O)C(=O)OC
InChI=1SC22H27NO5c115(2)1213281910617(71119)21(25)2320(22(26)273)14164818(24)9516h411152024H1214H213H3(H2325)
METHYL3(4HYDROXYPHENYL)2((4(3METHYLBUTOXY)BENZOYL)AMINO)PROPANOATE
METHYL3(4HYDROXYPHENYL)2((4(3METHYLBUTOXY)PHENYL)CARBONYLAMINO)PROPANOATE
methyl3(4hydroxyphenyl)2(4(isopentyloxy)benzamido)propanoate
methylN((4(3methylbutoxy)phenyl)carbonyl)tyrosinate
METHYLN(4(3METHYLBUTOXY)BENZOYL)DTYROSINATE
METHYLN(4(3METHYLBUTOXY)BENZOYL)LTYROSINATE
MFCD04143768
ZINC000001430221
ZINC000001430222

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Available files

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