Vitas-M small molecule compound
N-[3-(3-tert-butyl-5,9-dimethyl-7-oxo-7H-furo[3,2-g]chromen-6-yl)propanoyl]-beta-alanine
Catalog ID
STL464162
SMILES O=C(NCCC(=O)O)CCc1c(=O)oc2c(c1C)cc1c(c2C)occ1C(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 C23H27NO6 MW 413.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H27NO6/c1-12-14(6-7-18(25)24-9-8-19(26)27)22(28)30-21-13(2)20-16(10-15(12)21)17(11-29-20)23(3,4)5/h10-11H,6-9H2,1-5H3,(H,24,25)(H,26,27)InChIKey
BZQVIMZPDNDKCZ-UHFFFAOYSA-NSynonyms
859858-90-53(3(3(tertbutyl)59dimethyl7oxo7Hfuro(32g)chromen6yl)propanamido)propanoicacid
3(3(3TERTBUTYL59DIMETHYL7OXOFURO(32G)CHROMEN6YL)PROPANOYLAMINO)PROPANOICACID
859858905
CC1=C(C(=O)OC2=C1C=C3C(=COC3=C2C)C(C)(C)C)CCC(=O)NCCC(=O)O
InChI=1SC23H27NO6c11214(6718(25)249819(26)27)22(28)302113(2)2016(1015(12)21)17(112920)23(34)5h1011H69H215H3(H2425)(H2627)
MFCD05672889
N(3(3tertbutyl59dimethyl7oxo7Hfuro(32g)chromen6yl)propanoyl)betaalanine
ZINC000002113600
ZINC2113600
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