Vitas-M small molecule compound
2-(7,8-dimethoxy-4-methyl-2-oxo-2H-chromen-3-yl)-N-[(11aS)-11-hydroxy-5-oxo-2,3,5,11a-tetrahydro-1H-pyrrolo[2,1-c][1,4]benzodiazepin-7-yl]acetamide
Catalog ID
STL539001
SMILES COc1c(OC)ccc2c1oc(=O)c(c2C)CC(=O)Nc1ccc2c(c1)C(=O)N1CCC[C@H]1C(=N2)O
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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 C26H25N3O7 MW 491.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H25N3O7/c1-13-15-7-9-20(34-2)23(35-3)22(15)36-26(33)16(13)12-21(30)27-14-6-8-18-17(11-14)25(32)29-10-4-5-19(29)24(31)28-18/h6-9,11,19H,4-5,10,12H2,1-3H3,(H,27,30)(H,28,31)/t19-/m0/s1InChIKey
SRMNAUDTTQNNHU-IBGZPJMESA-NSynonyms
1574472-06-2~(N)((6~(a)~(S))611dioxo6~(a)789tetrahydro5~(H)pyrrolo(21c)(14)benzodiazepin2yl)2(78dimethoxy4methyl2oxochromen3yl)acetamide
1574472062
2(78dimethoxy4methyl2oxo2Hchromen3yl)N((11aS)11hydroxy5oxo23511atetrahydro1Hpyrrolo(21c)(14)benzodiazepin7yl)acetamide
71827059
InChI=1SC26H25N3O7c113157920(342)23(353)22(15)3626(33)16(13)1221(30)2714681817(1114)25(32)29104519(29)24(31)2818h691119H451012H213H3(H2730)(H2831)t19m0s1
ZINC000096114244
ZINC96114244
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