Vitas-M small molecule compound
methyl (6-chloro-7-hydroxy-4-methyl-2-oxo-8-{[(1S,5R)-8-oxo-1,5,6,8-tetrahydro-2H-1,5-methanopyrido[1,2-a][1,5]diazocin-3(4H)-yl]methyl}-2H-chromen-3-yl)acetate
Catalog ID
STL550165
SMILES COC(=O)Cc1c(=O)oc2c(c1C)cc(c(c2CN1C[C@H]2C[C@@H](C1)c1n(C2)c(=O)ccc1)O)Cl
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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 C25H25ClN2O6 MW 484.94 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H25ClN2O6/c1-13-16-7-19(26)23(31)18(24(16)34-25(32)17(13)8-22(30)33-2)12-27-9-14-6-15(11-27)20-4-3-5-21(29)28(20)10-14/h3-5,7,14-15,31H,6,8-12H2,1-2H3/t14-,15+/m1/s1InChIKey
IHCMAFXMYUQGGQ-CABCVRRESA-NSynonyms
125429020
COC(=O)Cc1c(=O)oc2c(c1C)cc(c(c2CN1C(C@H)2C(C@@H)(C1)c1n(C2)c(=O)ccc1)O)Cl
InChI=1SC25H25ClN2O6c11316719(26)23(31)18(24(16)3425(32)17(13)822(30)332)1227914615(1127)2043521(29)28(20)1014h357141531H6812H212H3t1415+m1s1
methyl(6chloro7hydroxy4methyl2oxo8(((1S5R)8oxo1568tetrahydro2H15methanopyrido(12a)(15)diazocin3(4H)yl)methyl)2Hchromen3yl)acetate
methyl2(6chloro7hydroxy4methyl2oxo8(((1~(S)9~(R))6oxo711diazatricyclo(7310^(27))trideca24dien11yl)methyl)chromen3yl)acetate
methyl2(6chloro7hydroxy4methyl2oxo8(((1R5S)8oxo56dihydro1H15methanopyrido(12a)(15)diazocin3(2H4H8H)yl)methyl)2Hchromen3yl)acetate
ZINC000524730409
ZINC524730409
Check stock
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