Vitas-M small molecule compound
4-[(4-benzylpiperidinium-1-yl)methyl]-8-methyl-2-oxo-2H-chromen-7-olate
Catalog ID
STK597806
SMILES O=c1cc(C[NH+]2CCC(CC2)Cc2ccccc2)c2c(o1)c(C)c(cc2)[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 C23H25NO3 MW 363.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H25NO3/c1-16-21(25)8-7-20-19(14-22(26)27-23(16)20)15-24-11-9-18(10-12-24)13-17-5-3-2-4-6-17/h2-8,14,18,25H,9-13,15H2,1H3InChIKey
UJRNGDGSRAMBPW-UHFFFAOYSA-NSynonyms
847932-18-74((4BENZYLPIPERIDIN1YL)METHYL)7HYDROXY8METHYLCHROMEN2ONE
4((4benzylpiperidinium1yl)methyl)8methyl2oxo2Hchromen7olate
7HYDROXY8METHYL4((4BENZYLPIPERIDYL)METHYL)CHROMEN2ONE
CC1=C(C=CC2=C1OC(=O)C=C2CN3CCC(CC3)CC4=CC=CC=C4)O
InChI=1SC23H25NO3c11621(25)872019(1422(26)2723(16)20)152411918(101224)13175324617h28141825H91315H21H3
MFCD06597767
O=c1cc(C(NH+)2CCC(CC2)Cc2ccccc2)c2c(o1)c(C)c(cc2)(O)
ZINC000002211816
ZINC2211816
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