Vitas-M small molecule compound

methyl 3-hydroxy-5-{3-methyl-1-oxo-1-[(1S,5R)-8-oxo-1,5,6,8-tetrahydro-2H-1,5-methanopyrido[1,2-a][1,5]diazocin-3(4H)-yl]pentan-2-yl}-5H-pyrazolo[4,3-c]pyridine-7-carboxylate

Catalog ID
STL547514
SMILES CCC(C(C(=O)N1C[C@H]2C[C@@H](C1)c1n(C2)c(=O)ccc1)n1cc(C(=O)OC)c2c(c1)c(O)nn2)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 C25H29N5O5 MW 479.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H29N5O5/c1-4-14(2)22(28-12-17-21(26-27-23(17)32)18(13-28)25(34)35-3)24(33)29-9-15-8-16(11-29)19-6-5-7-20(31)30(19)10-15/h5-7,12-16,22H,4,8-11H2,1-3H3,(H,27,32)/t14?,15-,16+,22?/m0/s1
InChIKey
MAOLXOUQLWUQFC-XNROWMOSSA-N
Synonyms

InChI=1SC25H29N5O5c1414(2)22(28121721(262723(17)32)18(1328)25(34)353)24(33)29915816(1129)1965720(31)30(19)1015h57121622H4811H213H3(H2732)t14?1516+22?m0s1
methyl3hydroxy5(3methyl1oxo1((1S5R)8oxo1568tetrahydro2H15methanopyrido(12a)(15)diazocin3(4H)yl)pentan2yl)5Hpyrazolo(43c)pyridine7carboxylate
ZINC000263585750
ZINC000409415501

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Available files

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