Vitas-M small molecule compound
(3alpha,5beta,7beta,8xi)-3,7-dihydroxy-N-[(2E)-6-methoxy-1,3-benzothiazol-2(3H)-ylidene]cholan-24-amide
Catalog ID
STL536392
SMILES COc1ccc2c(c1)s/c(=N/C(=O)CC[C@H]([C@H]1CC[C@@H]3[C@]1(C)CC[C@H]1[C@H]3[C@@H](O)C[C@H]3[C@]1(C)CC[C@H](C3)O)C)/[nH]2
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 C32H46N2O4S MW 554.79 g/mol Purity >90% as per NMR
InChI
InChI=1S/C32H46N2O4S/c1-18(5-10-28(37)34-30-33-25-9-6-21(38-4)17-27(25)39-30)22-7-8-23-29-24(12-14-32(22,23)3)31(2)13-11-20(35)15-19(31)16-26(29)36/h6,9,17-20,22-24,26,29,35-36H,5,7-8,10-16H2,1-4H3,(H,33,34,37)/t18-,19+,20-,22-,23+,24+,26+,29+,31+,32-/m1/InChIKey
YPOMQKCZBMEYKS-IOCBSAKTSA-NSynonyms
(3alpha5beta7beta8xi)37dihydroxyN((2E)6methoxy13benzothiazol2(3H)ylidene)cholan24amide
(4~(R))4((3~(R)5~(S)7~(S)8~(R)9~(S)10~(S)13~(R)14~(S)17~(R))37dihydroxy1013dimethyl23456789111214151617tetradecahydro1~(H)cyclopenta(a)phenanthren17yl)~(N)(6methoxy13benzothiazol2yl)pentanamide
52994373
InChI=1SC32H46N2O4Sc118(51028(37)343033259621(384)1727(25)3930)2278232924(121432(2223)3)31(2)131120(35)1519(31)1626(29)36h691720222426293536H5781016H214H3(H333437)t1819+202223+24+26+29+31+32m1s1
ZINC000070666147
ZINC70666147
Check stock
See real-time availability and sample size for STL536392 on the Vitas-M platform.
Check stock on Vitas-MAvailable files
Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.