Vitas-M small molecule compound
6-oxo-4-(piperidinium-1-ylmethyl)-6,7,8,9,10,11-hexahydrocyclohepta[c]chromen-3-olate
Catalog ID
STL040424
SMILES [O-]c1ccc2c(c1C[NH+]1CCCCC1)oc(=O)c1c2CCCCC1
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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/c22-18-10-9-15-14-7-3-1-4-8-16(14)20(23)24-19(15)17(18)13-21-11-5-2-6-12-21/h9-10,22H,1-8,11-13H2InChIKey
GGUZEBCHMIFFJH-UHFFFAOYSA-NSynonyms
843622-96-8(O)c1ccc2c(c1C(NH+)1CCCCC1)oc(=O)c1c2CCCCC1
3hydroxy4(piperidin1ylmethyl)891011tetrahydro7Hcyclohepta(c)chromen6one
6oxo4(piperidinium1ylmethyl)67891011hexahydrocyclohepta(c)chromen3olate
843622968
C1CCC2=C(CC1)C(=O)OC3=C2C=CC(=C3CN4CCCCC4)O
InChI=1SC20H25NO3c221810915147314816(14)20(23)2419(15)17(18)1321115261221h91022H181113H2
MFCD04013769
ZINC000005025772
ZINC5025772
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