Vitas-M small molecule compound
6-methyl-8-[(3-methylpiperidinium-1-yl)methyl]-4-oxo-1,2,3,4-tetrahydrocyclopenta[c]chromen-7-olate
Catalog ID
STL039362
SMILES CC1CCC[NH+](C1)Cc1cc2c(c(c1[O-])C)oc(=O)c1c2CCC1
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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 C20H25NO3 MW 327.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H25NO3/c1-12-5-4-8-21(10-12)11-14-9-17-15-6-3-7-16(15)20(23)24-19(17)13(2)18(14)22/h9,12,22H,3-8,10-11H2,1-2H3InChIKey
QQUSMDJNSUOXTP-UHFFFAOYSA-NSynonyms
710947-74-36METHYL8((3METHYLPIPERIDIN1IUM1YL)METHYL)4OXO23DIHYDRO1HCYCLOPENTA(C)CHROMEN7OLATE
6methyl8((3methylpiperidinium1yl)methyl)4oxo1234tetrahydrocyclopenta(c)chromen7olate
710947743
7HYDROXY6METHYL8((3METHYLPIPERIDIN1YL)METHYL)23DIHYDRO1HCYCLOPENTA(C)CHROMEN4ONE
CC1CCC(NH+)(C1)Cc1cc2c(c(c1(O))C)oc(=O)c1c2CCC1
CC1CCCN(C1)CC2=C(C(=C3C(=C2)C4=C(CCC4)C(=O)O3)C)O
InChI=1SC20H25NO3c11254821(1012)11149171563716(15)20(23)2419(17)13(2)18(14)22h91222H381011H212H3
MFCD04010747
ZINC000005025275
ZINC000005025276
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