Vitas-M small molecule compound

2-({[2-({3,4,5-tris(acetyloxy)-6-[(acetyloxy)methyl]tetrahydro-2H-pyran-2-yl}oxy)phenyl]carbonyl}amino)propanoic acid (non-preferred name)

Catalog ID
STL480768
SMILES CC(=O)OCC1OC(Oc2ccccc2C(=O)NC(C(=O)O)C)C(C(C1OC(=O)C)OC(=O)C)OC(=O)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 C24H29NO13 MW 539.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H29NO13/c1-11(23(31)32)25-22(30)16-8-6-7-9-17(16)37-24-21(36-15(5)29)20(35-14(4)28)19(34-13(3)27)18(38-24)10-33-12(2)26/h6-9,11,18-21,24H,10H2,1-5H3,(H,25,30)(H,31,32)
InChIKey
OLRQIHVNPGAOJM-UHFFFAOYSA-N
Synonyms

2(((2((345tris(acetyloxy)6((acetyloxy)methyl)tetrahydro2Hpyran2yl)oxy)phenyl)carbonyl)amino)propanoicacid(nonpreferredname)
2((2(345triacetyloxy6(acetyloxymethyl)oxan2yl)oxybenzoyl)amino)propanoicacid
CC(C(=O)O)NC(=O)C1=CC=CC=C1OC2C(C(C(C(O2)COC(=O)C)OC(=O)C)OC(=O)C)OC(=O)C
InChI=1SC24H29NO13c111(23(31)32)2522(30)16867917(16)372421(3615(5)29)20(3514(4)28)19(3413(3)27)18(3824)103312(2)26h6911182124H10H215H3(H2530)(H3132)
MFCD30713180
ZINC000334160909
ZINC000334160912

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Available files

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