Vitas-M small molecule compound
2-methoxy-4-(3,3,6,6-tetramethyl-1,8-dioxo-2,3,4,5,6,7,8,9-octahydro-1H-xanthen-9-yl)phenyl (3-chlorophenyl)carbamate
Catalog ID
STK760968
SMILES COc1cc(ccc1OC(=O)Nc1cccc(c1)Cl)C1C2=C(OC3=C1C(=O)CC(C3)(C)C)CC(CC2=O)(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 C31H32ClNO6 MW 550.05 g/mol Purity >90% as per NMR
InChI
InChI=1S/C31H32ClNO6/c1-30(2)13-20(34)27-24(15-30)38-25-16-31(3,4)14-21(35)28(25)26(27)17-9-10-22(23(11-17)37-5)39-29(36)33-19-8-6-7-18(32)12-19/h6-12,26H,13-16H2,1-5H3,(H,33,36)InChIKey
GSXVROLUQVMSNB-UHFFFAOYSA-NSynonyms
(2methoxy4(3366tetramethyl18dioxo4579tetrahydro2Hxanthen9yl)phenyl)N(3chlorophenyl)carbamate
2methoxy4(3366tetramethyl18dioxo23456789octahydro1Hxanthen9yl)phenyl(3chlorophenyl)carbamate
CC1(CC2=C(C(C3=C(O2)CC(CC3=O)(C)C)C4=CC(=C(C=C4)OC(=O)NC5=CC(=CC=C5)Cl)OC)C(=O)C1)C
InChI=1SC31H32ClNO6c130(2)1320(34)2724(1530)38251631(34)1421(35)28(25)26(27)1791022(23(1117)375)3929(36)331986718(32)1219h61226H1316H215H3(H3336)
MFCD01593684
ZINC000001064758
ZINC01064758
ZINC1064758
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