Vitas-M small molecule compound

N-(4-hydroxy-1,1-dioxidotetrahydrothiophen-3-yl)-2-(5-methoxy-4,8,8-trimethyl-2-oxo-9,10-dihydro-2H,8H-pyrano[2,3-f]chromen-3-yl)acetamide

Catalog ID
STK619477
SMILES COc1cc2OC(C)(C)CCc2c2c1c(C)c(CC(=O)NC1CS(=O)(=O)CC1O)c(=O)o2

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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 C22H27NO8S MW 465.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H27NO8S/c1-11-13(7-18(25)23-14-9-32(27,28)10-15(14)24)21(26)30-20-12-5-6-22(2,3)31-16(12)8-17(29-4)19(11)20/h8,14-15,24H,5-7,9-10H2,1-4H3,(H,23,25)
InChIKey
HLLGBHFMINZYGR-UHFFFAOYSA-N
Synonyms
1014412-14-6
1014412146
CC1=C(C(=O)OC2=C3CCC(OC3=CC(=C12)OC)(C)C)CC(=O)NC4CS(=O)(=O)CC4O
InChI=1SC22H27NO8Sc11113(718(25)2314932(2728)1015(14)24)21(26)3020125622(23)3116(12)817(294)19(11)20h8141524H57910H214H3(H2325)
N(4hydroxy11dioxidotetrahydrothiophen3yl)2(5methoxy488trimethyl2oxo28910tetrahydropyrano(23f)chromen3yl)acetamide
N(4hydroxy11dioxidotetrahydrothiophen3yl)2(5methoxy488trimethyl2oxo910dihydro2H8Hpyrano(23f)chromen3yl)acetamide
N(4hydroxy11dioxothiolan3yl)2(5methoxy488trimethyl2oxo910dihydropyrano(23h)chromen3yl)acetamide
ZINC000013692790
ZINC000013692793

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Available files

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