Vitas-M small molecule compound

pentyl 4-(3-hydroxyphenyl)-2,7,7-trimethyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate

Catalog ID
STK000412
SMILES CCCCCOC(=O)C1=C(C)NC2=C(C1c1cccc(c1)O)C(=O)CC(C2)(C)C

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 C24H31NO4 MW 397.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H31NO4/c1-5-6-7-11-29-23(28)20-15(2)25-18-13-24(3,4)14-19(27)22(18)21(20)16-9-8-10-17(26)12-16/h8-10,12,21,25-26H,5-7,11,13-14H2,1-4H3
InChIKey
TWCNNKMVJGPHSN-UHFFFAOYSA-N
Synonyms
299945-90-7
299945907
CCCCCOC(=O)C1=C(C)NC2=C(C1c1cccc(c1)O)C(=O)CC(C2)(C)C
CCCCCOC(=O)C1=C(NC2=C(C1C3=CC(=CC=C3)O)C(=O)CC(C2)(C)C)C
InChI=1SC24H31NO4c1567112923(28)2015(2)25181324(34)1419(27)22(18)21(20)16981017(26)1216h81012212526H57111314H214H3
MFCD00717910
pentyl4(3hydroxyphenyl)277trimethyl5oxo145678hexahydroquinoline3carboxylate
pentyl4(3hydroxyphenyl)277trimethyl5oxo1468tetrahydroquinoline3carboxylate
STK000412
ZINC000017723883
ZINC000096316579

Check stock

See real-time availability and sample size for STK000412 on the Vitas-M platform.

Check stock on Vitas-M

Available files

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