Vitas-M small molecule compound

4-[(N-{[4-(pentyloxy)phenyl]carbonyl}-beta-alanyl)amino]butanoate

Catalog ID
STL043228
SMILES CCCCCOc1ccc(cc1)C(=O)NCCC(=O)NCCCC(=O)[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 C19H27N2O5 MW 363.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H28N2O5/c1-2-3-4-14-26-16-9-7-15(8-10-16)19(25)21-13-11-17(22)20-12-5-6-18(23)24/h7-10H,2-6,11-14H2,1H3,(H,20,22)(H,21,25)(H,23,24)/p-1
InChIKey
YOPJWEHYUXRVBZ-UHFFFAOYSA-M
Synonyms

4((N((4(pentyloxy)phenyl)carbonyl)betaalanyl)amino)butanoate
4(3((4PENTOXYBENZOYL)AMINO)PROPANOYLAMINO)BUTANOATE
CCCCCOC1=CC=C(C=C1)C(=O)NCCC(=O)NCCCC(=O)(O)
CCCCCOc1ccc(cc1)C(=O)NCCC(=O)NCCCC(=O)(O)
CCCCCOc1ccc(cc1)C(=O)NCCC(=O)NCCCC(=O)(O)(Na+)
InChI=1SC19H28N2O5c12341426169715(81016)19(25)21131117(22)20125618(23)24h710H261114H21H3(H2022)(H2125)(H2324)p1
sodium4(3(4(pentyloxy)benzamido)propanamido)butanoate
ZINC04023582

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Available files

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