Vitas-M small molecule compound

3-(8-oxo-1,5,6,8-tetrahydro-2H-1,5-methanopyrido[1,2-a][1,5]diazocin-3(4H)-yl)propanoic acid

Catalog ID
STL560749
SMILES OC(=O)CCN1CC2CC(C1)c1n(C2)c(=O)ccc1

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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 C14H18N2O3 MW 262.31 g/mol Purity >90% as per NMR
InChI
InChI=1S/C14H18N2O3/c17-13-3-1-2-12-11-6-10(8-16(12)13)7-15(9-11)5-4-14(18)19/h1-3,10-11H,4-9H2,(H,18,19)
InChIKey
OWFOEFGESDNNNR-UHFFFAOYSA-N
Synonyms

3((1R5S)8oxo56dihydro1H15methanopyrido(12a)(15)diazocin3(2H4H8H)yl)propanoicacid
3(6oxo7aza11azoniatricyclo(731027)trideca24dien11yl)propanoate
3(8oxo1568tetrahydro2H15methanopyrido(12a)(15)diazocin3(4H)yl)propanoicacid
4606077
InChI=1SC14H18N2O3c17133121211610(816(12)13)715(911)5414(18)19h131011H49H2(H1819)
MFCD07375412
OC(=O)CCN1C(C@@H)2C(C@@H)(C1)c1n(C2)c(=O)ccc1
ZINC000000265614

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.