Vitas-M small molecule compound

(2S)-{[(3,5-dimethyl-7-oxo-7H-furo[3,2-g]chromen-6-yl)acetyl]amino}(4-hydroxyphenyl)ethanoic acid

Catalog ID
STL464435
SMILES O=C(Cc1c(=O)oc2c(c1C)cc1c(c2)occ1C)N[C@@H](c1ccc(cc1)O)C(=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 C23H19NO7 MW 421.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H19NO7/c1-11-10-30-18-9-19-16(7-15(11)18)12(2)17(23(29)31-19)8-20(26)24-21(22(27)28)13-3-5-14(25)6-4-13/h3-7,9-10,21,25H,8H2,1-2H3,(H,24,26)(H,27,28)/t21-/m0/s1
InChIKey
RUQXWFPWTDQOGR-NRFANRHFSA-N
Synonyms
1212374-41-8
(2S)(((35dimethyl7oxo7Hfuro(32g)chromen6yl)acetyl)amino)(4hydroxyphenyl)ethanoicacid
(2S)2((2(35DIMETHYL7OXOFURO(32G)CHROMEN6YL)ACETYL)AMINO)2(4HYDROXYPHENYL)ACETICACID
(S)2(2(35dimethyl7oxo7Hfuro(32g)chromen6yl)acetamido)2(4hydroxyphenyl)aceticacid
1212374418
CC1=COC2=CC3=C(C=C12)C(=C(C(=O)O3)CC(=O)NC(C4=CC=C(C=C4)O)C(=O)O)C
InChI=1SC23H19NO7c11110301891916(715(11)18)12(2)17(23(29)3119)820(26)2421(22(27)28)133514(25)6413h379102125H8H212H3(H2426)(H2728)t21m0s1
MFCD05673957
O=C(Cc1c(=O)oc2c(c1C)cc1c(c2)occ1C)N(C@@H)(c1ccc(cc1)O)C(=O)O
ZINC000002117575
ZINC2117575

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Available files

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