Vitas-M small molecule compound
12-chloro-3-(3,4,5-trimethoxybenzyl)-3,4,7,8,9,10-hexahydro-2H,6H-benzo[3,4]chromeno[8,7-e][1,3]oxazin-6-one
Catalog ID
STL460066
SMILES COc1cc(CN2COc3c(C2)c2oc(=O)c4c(c2cc3Cl)CCCC4)cc(c1OC)OC
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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 C25H26ClNO6 MW 471.94 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H26ClNO6/c1-29-20-8-14(9-21(30-2)24(20)31-3)11-27-12-18-22-17(10-19(26)23(18)32-13-27)15-6-4-5-7-16(15)25(28)33-22/h8-10H,4-7,11-13H2,1-3H3InChIKey
PDQUHLDEZYDNFT-UHFFFAOYSA-NSynonyms
858761-46-312chloro3((345trimethoxyphenyl)methyl)2478910hexahydroisochromeno(34f)(13)benzoxazin6one
12chloro3(345trimethoxybenzyl)3478910hexahydro2H6Hbenzo(34)chromeno(87e)(13)oxazin6one
12chloro3(345trimethoxybenzyl)3478910hexahydrobenzo(34)chromeno(87e)(13)oxazin6(2H)one
858761463
COC1=CC(=CC(=C1OC)OC)CN2CC3=C4C(=CC(=C3OC2)Cl)C5=C(CCCC5)C(=O)O4
InChI=1SC25H26ClNO6c12920814(921(302)24(20)313)112712182217(1019(26)23(18)321327)15645716(15)25(28)3322h810H471113H213H3
MFCD04143541
ZINC000020411552
ZINC20411552
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