Vitas-M small molecule compound

4-methoxybenzyl 7-(furan-2-yl)-2-methyl-4-(6-methyl-4-oxo-4H-chromen-3-yl)-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate

Catalog ID
STK406088
SMILES COc1ccc(cc1)COC(=O)C1=C(C)NC2=C(C1c1coc3c(c1=O)cc(cc3)C)C(=O)CC(C2)c1ccco1

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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 C33H29NO7 MW 551.60 g/mol Purity >90% as per NMR
InChI
InChI=1S/C33H29NO7/c1-18-6-11-28-23(13-18)32(36)24(17-40-28)30-29(33(37)41-16-20-7-9-22(38-3)10-8-20)19(2)34-25-14-21(15-26(35)31(25)30)27-5-4-12-39-27/h4-13,17,21,30,34H,14-16H2,1-3H3
InChIKey
PETUSRGDYYUVQO-UHFFFAOYSA-N
Synonyms

(4methoxyphenyl)methyl7(furan2yl)2methyl4(6methyl4oxochromen3yl)5oxo4678tetrahydro1Hquinoline3carboxylate
4methoxybenzyl7(furan2yl)2methyl4(6methyl4oxo4Hchromen3yl)5oxo145678hexahydroquinoline3carboxylate
CC1=CC2=C(C=C1)OC=C(C2=O)C3C4=C(CC(CC4=O)C5=CC=CO5)NC(=C3C(=O)OCC6=CC=C(C=C6)OC)C
InChI=1SC33H29NO7c1186112823(1318)32(36)24(174028)3029(33(37)4116207922(383)10820)19(2)34251421(1526(35)31(25)30)2754123927h41317213034H1416H213H3
MFCD04216312
ZINC000001129787
ZINC000001129799

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Available files

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