Vitas-M small molecule compound

(2-hydroxy-2,5,5,8a-tetramethyldecahydronaphthalen-1-yl)acetic acid

Catalog ID
STK055995
SMILES OC(=O)CC1C(C)(O)CCC2C1(C)CCCC2(C)C

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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 C16H28O3 MW 268.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H28O3/c1-14(2)7-5-8-15(3)11(14)6-9-16(4,19)12(15)10-13(17)18/h11-12,19H,5-10H2,1-4H3,(H,17,18)
InChIKey
ASWLRRLLSBVSOH-UHFFFAOYSA-N
Synonyms

(2hydroxy2558atetramethyldecahydronaphthalen1yl)aceticacid
2((1R2R4aS8aS)2hydroxy2558atetramethyldecahydronaphthalen1yl)aceticacid
2(2hydroxy2558atetramethyl344a678hexahydro1Hnaphthalen1yl)aceticacid
CC1(CCCC2(C1CCC(C2CC(=O)O)(C)O)C)C
InChI=1SC16H28O3c114(2)75815(3)11(14)6916(419)12(15)1013(17)18h111219H510H214H3(H1718)
MFCD00809220
OC(=O)C(C@H)1(C@)(C)(O)CC(C@@H)2(C@)1(C)CCCC2(C)C
OC(=O)CC1C(C)(O)CCC2C1(C)CCCC2(C)C
STK055995
ZINC000003109057
ZINC000247994862

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Available files

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