Vitas-M small molecule compound

5-methoxy-2-(6'-methoxy-1',3',4',9a'-tetrahydrospiro[cyclohexane-1,9'-xanthen]-4a'(2'H)-yl)phenyl 4-bromobenzenesulfonate

Catalog ID
STK681830
SMILES COc1ccc(c(c1)OS(=O)(=O)c1ccc(cc1)Br)C12CCCCC2C2(c3c(O1)cc(OC)cc3)CCCCC2

Contact us by email for worldwide delivery information, pricing, and real‑time availability. Send us your quotation request, and we will confirm stock levels, provide exact costs and lead times, suggest alternatives or find analogs when helpful, and share any additional specifications you may need.

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 C32H35BrO6S MW 627.60 g/mol Purity >90% as per NMR
InChI
InChI=1S/C32H35BrO6S/c1-36-23-11-15-26-28(20-23)38-32(19-7-4-8-30(32)31(26)17-5-3-6-18-31)27-16-12-24(37-2)21-29(27)39-40(34,35)25-13-9-22(33)10-14-25/h9-16,20-21,30H,3-8,17-19H2,1-2H3
InChIKey
GQWWLKVNDMNIRO-UHFFFAOYSA-N
Synonyms

(5methoxy2(6methoxyspiro(2349atetrahydro1Hxanthene91cyclohexane)4ayl)phenyl)4bromobenzenesulfonate
5methoxy2(6methoxy1349atetrahydrospiro(cyclohexane19xanthen)4a(2H)yl)phenyl4bromobenzenesulfonate
COC1=CC2=C(C=C1)C3(CCCCC3)C4CCCCC4(O2)C5=C(C=C(C=C5)OC)OS(=O)(=O)C6=CC=C(C=C6)Br
InChI=1SC32H35BrO6Sc1362311152628(2023)3832(1974830(32)31(26)175361831)27161224(372)2129(27)3940(3435)2513922(33)101425h916202130H381719H212H3
MFCD03820218
ZINC000098005265
ZINC000098005268

Check stock

See real-time availability and sample size for STK681830 on the Vitas-M platform.

Check stock on Vitas-M

Available files

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