Vitas-M small molecule compound

tricyclo[3.3.1.1~3,7~]decane-1,3,5-tricarboxylic acid

Catalog ID
STK553284
SMILES OC(=O)C12CC3CC(C2)(CC(C1)(C3)C(=O)O)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 C13H16O6 MW 268.27 g/mol Purity >90% as per NMR
InChI
InChI=1S/C13H16O6/c14-8(15)11-1-7-2-12(4-11,9(16)17)6-13(3-7,5-11)10(18)19/h7H,1-6H2,(H,14,15)(H,16,17)(H,18,19)
InChIKey
IGSDAEDEJRBTEJ-UHFFFAOYSA-N
Synonyms
213274-89-6
(1s3s5s)adamantane135tricarboxylicacid
135TRICARBOXYADAMANTANE
213274896
ADAMANTANE135TRICARBOXYLICACID
C1C2CC3(CC1(CC(C2)(C3)C(=O)O)C(=O)O)C(=O)O
InChI=1SC13H16O6c148(15)1117212(4119(16)17)613(37511)10(18)19h7H16H2(H1415)(H1617)(H1819)
MFCD02208212
tricyclo(3311~37~)decane135tricarboxylicacid
ZINC000000207852
ZINC207852

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Available files

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