Vitas-M small molecule compound

N-{[(4-methyl-6-oxo-7,8,9,10-tetrahydro-6H-benzo[c]chromen-3-yl)oxy]acetyl}glycyl-D-valine

Catalog ID
STL531119
SMILES O=C(COc1ccc2c(c1C)oc(=O)c1c2CCCC1)NCC(=O)N[C@@H](C(=O)O)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 C23H28N2O7 MW 444.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H28N2O7/c1-12(2)20(22(28)29)25-18(26)10-24-19(27)11-31-17-9-8-15-14-6-4-5-7-16(14)23(30)32-21(15)13(17)3/h8-9,12,20H,4-7,10-11H2,1-3H3,(H,24,27)(H,25,26)(H,28,29)/t20-/m1/s1
InChIKey
RXLNFPDLAMNJEM-HXUWFJFHSA-N
Synonyms

(2~(R))3methyl2((2((2((4methyl6oxo78910tetrahydrobenzo(c)chromen3yl)oxy)acetyl)amino)acetyl)amino)butanoicacid
(S)3methyl2(2(2((4methyl6oxo78910tetrahydro6Hbenzo(c)chromen3yl)oxy)acetamido)acetamido)butanoicacid
124358002
InChI=1SC23H28N2O7c112(2)20(22(28)29)2518(26)102419(27)113117981514645716(14)23(30)3221(15)13(17)3h891220H471011H213H3(H2427)(H2526)(H2829)t20m1s1
N(((4methyl6oxo78910tetrahydro6Hbenzo(c)chromen3yl)oxy)acetyl)glycylDvaline
O=C(COc1ccc2c(c1C)oc(=O)c1c2CCCC1)NCC(=O)N(C@H)(C(=O)O)C(C)C
ZINC000015956069

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.