Vitas-M small molecule compound

3-(3-hydroxy-4-oxo-6-{[(1S,5R)-8-oxo-1,5,6,8-tetrahydro-2H-1,5-methanopyrido[1,2-a][1,5]diazocin-3(4H)-yl]methyl}-4H-pyran-2-yl)-3-(4-hydroxyphenyl)propanamide

Catalog ID
STL549309
SMILES NC(=O)CC(c1oc(CN2C[C@H]3C[C@@H](C2)c2n(C3)c(=O)ccc2)cc(=O)c1O)c1ccc(cc1)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 C26H27N3O6 MW 477.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H27N3O6/c27-23(32)10-20(16-4-6-18(30)7-5-16)26-25(34)22(31)9-19(35-26)14-28-11-15-8-17(13-28)21-2-1-3-24(33)29(21)12-15/h1-7,9,15,17,20,30,34H,8,10-14H2,(H2,27,32)/t15-,17+,20?/m1/s1
InChIKey
FEUJVEVSYGIURN-MNQXGVLQSA-N
Synonyms

129895123
3(3hydroxy4oxo6(((1~(S)9~(R))6oxo711diazatricyclo(7310^(27))trideca24dien11yl)methyl)pyran2yl)3(4hydroxyphenyl)propanamide
3(3hydroxy4oxo6(((1R5S)8oxo56dihydro1H15methanopyrido(12a)(15)diazocin3(2H4H8H)yl)methyl)4Hpyran2yl)3(4hydroxyphenyl)propanamide
3(3hydroxy4oxo6(((1S5R)8oxo1568tetrahydro2H15methanopyrido(12a)(15)diazocin3(4H)yl)methyl)4Hpyran2yl)3(4hydroxyphenyl)propanamide
InChI=1SC26H27N3O6c2723(32)1020(164618(30)7516)2625(34)22(31)919(3526)14281115817(1328)2121324(33)29(21)1215h1791517203034H81014H2(H22732)t1517+20?m1s1
NC(=O)CC(c1oc(CN2C(C@H)3C(C@@H)(C2)c2n(C3)c(=O)ccc2)cc(=O)c1O)c1ccc(cc1)O
ZINC000524729691
ZINC000524729692

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Available files

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