Vitas-M small molecule compound
N~2~-[7-(acetylamino)-1,2,3-trimethoxy-9-oxo-5,6,7,9-tetrahydrobenzo[a]heptalen-10-yl]-N-[5-(methoxymethyl)-1H-1,2,4-triazol-3-yl]isoleucinamide
Catalog ID
STL550982
SMILES COCc1[nH]nc(n1)NC(=O)C(C(CC)C)Nc1ccc2c(cc1=O)C(CCc1c2c(OC)c(c(c1)OC)OC)NC(=O)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 C31H40N6O7 MW 608.69 g/mol Purity >90% as per NMR
InChI
InChI=1S/C31H40N6O7/c1-8-16(2)27(30(40)35-31-34-25(15-41-4)36-37-31)33-22-12-10-19-20(14-23(22)39)21(32-17(3)38)11-9-18-13-24(42-5)28(43-6)29(44-7)26(18)19/h10,12-14,16,21,27H,8-9,11,15H2,1-7H3,(H,32,38)(H,33,39)(H2,34,35,36,37,40)InChIKey
HXIRFBWQLBDSHJ-UHFFFAOYSA-NSynonyms
(2S3R)2(((S)7acetamido123trimethoxy9oxo5679tetrahydrobenzo(a)heptalen10yl)amino)N(3(methoxymethyl)1H124triazol5yl)3methylpentanamide
132286486
2((7acetamido123trimethoxy9oxo67dihydro5~(H)benzo(a)heptalen10yl)amino)~(N)(5(methoxymethyl)1~(H)124triazol3yl)3methylpentanamide
COCc1n(nH)c(n1)NC(=O)(C@H)((C@@H)(CC)C)Nc1ccc2c(cc1=O)(C@H)(CCc1c2c(OC)c(c(c1)OC)OC)NC(=O)C
InChI=1SC31H40N6O7c1816(2)27(30(40)35313425(15414)363731)332212101920(1423(22)39)21(3217(3)38)119181324(425)28(436)29(447)26(18)19h101214162127H891115H217H3(H3238)(H3339)(H23435363740)
MFCD31757885
N~2~(7(acetylamino)123trimethoxy9oxo5679tetrahydrobenzo(a)heptalen10yl)N(5(methoxymethyl)1H124triazol3yl)isoleucinamide
ZINC000888090547
ZINC000888090550
Check stock
See real-time availability and sample size for STL550982 on the Vitas-M platform.
Check stock on Vitas-MAvailable files
Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.