Vitas-M small molecule compound

6-methyl-4-oxo-8-(piperidinium-1-ylmethyl)-1,2,3,4-tetrahydrocyclopenta[c]chromen-7-olate

Catalog ID
STL149655
SMILES [O-]c1c(C[NH+]2CCCCC2)cc2c(c1C)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 C19H23NO3 MW 313.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H23NO3/c1-12-17(21)13(11-20-8-3-2-4-9-20)10-16-14-6-5-7-15(14)19(22)23-18(12)16/h10,21H,2-9,11H2,1H3
InChIKey
AKQVGRIQAGGGGC-UHFFFAOYSA-N
Synonyms
710947-76-5
(O)c1c(C(NH+)2CCCCC2)cc2c(c1C)oc(=O)c1c2CCC1
6METHYL4OXO8(PIPERIDIN1IUM1YLMETHYL)23DIHYDRO1HCYCLOPENTA(C)CHROMEN7OLATE
6methyl4oxo8(piperidinium1ylmethyl)1234tetrahydrocyclopenta(c)chromen7olate
6METHYL7OXIDANYL8(PIPERIDIN1YLMETHYL)23DIHYDRO1HCYCLOPENTA(C)CHROMEN4ONE
710947765
7HYDROXY6METHYL8(1PIPERIDINYLMETHYL)23DIHYDRO1HCYCLOPENTA(C)(1)BENZOPYRAN4ONE
7HYDROXY6METHYL8(PIPERIDIN1YLMETHYL)23DIHYDRO1HCYCLOPENTA(C)CHROMEN4ONE
7HYDROXY6METHYL8(PIPERIDINOMETHYL)23DIHYDRO1HCYCLOPENTA(C)CHROMEN4ONE
CC1=C2C(=CC(=C1O)CN3CCCCC3)C4=C(CCC4)C(=O)O2
InChI=1SC19H23NO3c11217(21)13(11208324920)10161465715(14)19(22)2318(12)16h1021H2911H21H3
MFCD04012916
ZINC000005025600
ZINC5025600

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Available files

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