Vitas-M small molecule compound

4-{[3-(3-tert-butyl-5-methyl-7-oxo-7H-furo[3,2-g]chromen-6-yl)propanoyl]amino}butanoic acid

Catalog ID
STL464161
SMILES O=C(CCc1c(=O)oc2c(c1C)cc1c(c2)occ1C(C)(C)C)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 C23H27NO6 MW 413.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H27NO6/c1-13-14(7-8-20(25)24-9-5-6-21(26)27)22(28)30-19-11-18-16(10-15(13)19)17(12-29-18)23(2,3)4/h10-12H,5-9H2,1-4H3,(H,24,25)(H,26,27)
InChIKey
ROXOIUFTQOSJNQ-UHFFFAOYSA-N
Synonyms
859858-60-9
4((3(3tertbutyl5methyl7oxo7Hfuro(32g)chromen6yl)propanoyl)amino)butanoicacid
4(3(3(tertbutyl)5methyl7oxo7Hfuro(32g)chromen6yl)propanamido)butanoicacid
4(3(3TERTBUTYL5METHYL7OXOFURO(32G)CHROMEN6YL)PROPANOYLAMINO)BUTANOICACID
859858609
CC1=C(C(=O)OC2=C1C=C3C(=C2)OC=C3C(C)(C)C)CCC(=O)NCCCC(=O)O
InChI=1SC23H27NO6c11314(7820(25)2495621(26)27)22(28)3019111816(1015(13)19)17(122918)23(23)4h1012H59H214H3(H2425)(H2627)
MFCD05672851
ZINC000002113485
ZINC2113485

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Available files

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