Vitas-M small molecule compound
1-[2-(hydroxymethyl)-4,5-dimethoxyphenyl]cyclopentanecarboxylate
Catalog ID
STK386611
SMILES COc1cc(c(cc1OC)CO)C1(CCCC1)C(=O)[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 C15H19O5 MW 279.31 g/mol Purity >90% as per NMR
InChI
InChI=1S/C15H20O5/c1-19-12-7-10(9-16)11(8-13(12)20-2)15(14(17)18)5-3-4-6-15/h7-8,16H,3-6,9H2,1-2H3,(H,17,18)/p-1InChIKey
UCJNTMJYMJFWNX-UHFFFAOYSA-MSynonyms
1(2(HYDROXYMETHYL)45DIMETHOXYPHENYL)CYCLOPENTANE1CARBOXYLATE
1(2(hydroxymethyl)45dimethoxyphenyl)cyclopentanecarboxylate
COC1=C(C=C(C(=C1)CO)C2(CCCC2)C(=O)(O))OC
COc1cc(c(cc1OC)CO)C1(CCCC1)C(=O)(O)
COc1cc(c(cc1OC)CO)C1(CCCC1)C(=O)(O)(Na+)
InChI=1SC15H20O5c11912710(916)11(813(12)202)15(14(17)18)534615h7816H369H212H3(H1718)p1
MFCD00420705
sodium1(2(hydroxymethyl)45dimethoxyphenyl)cyclopentanecarboxylate
ZINC000000174642
ZINC00174642
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