Vitas-M small molecule compound

N-[(7-methoxy-8-methyl-2-oxo-2H-chromen-4-yl)acetyl]-D-phenylalanine

Catalog ID
STL464445
SMILES COc1ccc2c(c1C)oc(=O)cc2CC(=O)N[C@@H](C(=O)O)Cc1ccccc1

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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 C22H21NO6 MW 395.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H21NO6/c1-13-18(28-2)9-8-16-15(12-20(25)29-21(13)16)11-19(24)23-17(22(26)27)10-14-6-4-3-5-7-14/h3-9,12,17H,10-11H2,1-2H3,(H,23,24)(H,26,27)/t17-/m1/s1
InChIKey
XMUZJWQMFCEEEZ-QGZVFWFLSA-N
Synonyms

(2R)2((2(7methoxy8methyl2oxochromen4yl)acetyl)amino)3phenylpropanoicacid
(S)2(2(7methoxy8methyl2oxo2Hchromen4yl)acetamido)3phenylpropanoicacid
CC1=C(C=CC2=C1OC(=O)C=C2CC(=O)NC(CC3=CC=CC=C3)C(=O)O)OC
COc1ccc2c(c1C)oc(=O)cc2CC(=O)N(C@@H)(C(=O)O)Cc1ccccc1
COc1ccc2c(c1C)oc(=O)cc2CC(=O)N(C@H)(C(=O)O)Cc1ccccc1
InChI=1SC22H21NO6c11318(282)981615(1220(25)2921(13)16)1119(24)2317(22(26)27)10146435714h391217H1011H212H3(H2324)(H2627)t17m1s1
N((7methoxy8methyl2oxo2Hchromen4yl)acetyl)Dphenylalanine
ZINC000011865671
ZINC11865671

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Available files

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