Vitas-M small molecule compound

N-[(6,7-dimethoxy-4-methyl-2-oxo-2H-chromen-3-yl)acetyl]glycyl-D-valine

Catalog ID
STL464296
SMILES COc1cc2c(cc1OC)oc(=O)c(c2C)CC(=O)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 C21H26N2O8 MW 434.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H26N2O8/c1-10(2)19(20(26)27)23-18(25)9-22-17(24)7-13-11(3)12-6-15(29-4)16(30-5)8-14(12)31-21(13)28/h6,8,10,19H,7,9H2,1-5H3,(H,22,24)(H,23,25)(H,26,27)/t19-/m1/s1
InChIKey
LAQKJWXMPWDXOJ-LJQANCHMSA-N
Synonyms

(2R)2((2((2(67dimethoxy4methyl2oxochromen3yl)acetyl)amino)acetyl)amino)3methylbutanoicacid
(S)2(2(2(67dimethoxy4methyl2oxo2Hchromen3yl)acetamido)acetamido)3methylbutanoicacid
CC1=C(C(=O)OC2=CC(=C(C=C12)OC)OC)CC(=O)NCC(=O)NC(C(C)C)C(=O)O
COc1cc2c(cc1OC)oc(=O)c(c2C)CC(=O)NCC(=O)N(C@@H)(C(=O)O)C(C)C
COc1cc2c(cc1OC)oc(=O)c(c2C)CC(=O)NCC(=O)N(C@H)(C(=O)O)C(C)C
InChI=1SC21H26N2O8c110(2)19(20(26)27)2318(25)92217(24)71311(3)12615(294)16(305)814(12)3121(13)28h681019H79H215H3(H2224)(H2325)(H2627)t19m1s1
N((67dimethoxy4methyl2oxo2Hchromen3yl)acetyl)glycylDvaline
ZINC000011865638
ZINC11865638

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Available files

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