Vitas-M small molecule compound

methyl N-[3-(7-methoxy-4-methyl-2-oxo-2H-chromen-6-yl)propanoyl]valinate

Catalog ID
STL476218
SMILES COc1cc2oc(=O)cc(c2cc1CCC(=O)NC(C(=O)OC)C(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 C20H25NO6 MW 375.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H25NO6/c1-11(2)19(20(24)26-5)21-17(22)7-6-13-9-14-12(3)8-18(23)27-16(14)10-15(13)25-4/h8-11,19H,6-7H2,1-5H3,(H,21,22)
InChIKey
YRQLFWFRORQPBW-UHFFFAOYSA-N
Synonyms

(S)methyl2(3(7methoxy4methyl2oxo2Hchromen6yl)propanamido)3methylbutanoate
CC1=CC(=O)OC2=CC(=C(C=C12)CCC(=O)NC(C(C)C)C(=O)OC)OC
COc1cc2oc(=O)cc(c2cc1CCC(=O)N(C@H)(C(=O)OC)C(C)C)C
InChI=1SC20H25NO6c111(2)19(20(24)265)2117(22)761391412(3)818(23)2716(14)1015(13)254h81119H67H215H3(H2122)
methyl2(3(7methoxy4methyl2oxochromen6yl)propanoylamino)3methylbutanoate
methylN(3(7methoxy4methyl2oxo2Hchromen6yl)propanoyl)valinate
MFCD31751348
ZINC000170625516
ZINC000334162738

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Available files

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