Vitas-M small molecule compound
2-(heptyloxy)-5-sulfobenzoic acid
Catalog ID
STK378110
SMILES CCCCCCCOc1ccc(cc1C(=O)O)S(=O)(=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 C14H20O6S MW 316.38 g/mol Purity >90% as per NMR
InChI
InChI=1S/C14H20O6S/c1-2-3-4-5-6-9-20-13-8-7-11(21(17,18)19)10-12(13)14(15)16/h7-8,10H,2-6,9H2,1H3,(H,15,16)(H,17,18,19)InChIKey
OPSUOSKJINYJDB-UHFFFAOYSA-NSynonyms
2(heptyloxy)5sulfobenzoicacid
2HEPTOXY5SULFOBENZOICACID
2HEPTYLOXY5SULFOBENZOICACID
CCCCCCCOC1=C(C=C(C=C1)S(=O)(=O)O)C(=O)O
InChI=1SC14H20O6Sc123456920138711(21(1718)19)1012(13)14(15)16h7810H269H21H3(H1516)(H171819)
MFCD01823392
ZINC000102069769
ZINC102069769
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