VITAS-M Laboratory logo VITAS‑M Laboratory COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION
Vitas-M small molecule compound

methyl N-[(7S)-7-(acetylamino)-1,2,3-trimethoxy-9-oxo-5,6,7,9-tetrahydrobenzo[a]heptalen-10-yl]-L-isoleucyl-L-valinate

Catalog ID
STL542701
SMILES CC[C@@H]([C@@H](C(=O)N[C@H](C(=O)OC)C(C)C)Nc1ccc2c(cc1=O)[C@H](CCc1c2c(OC)c(c(c1)OC)OC)NC(=O)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 C33H45N3O8 MW 611.74 g/mol Purity >90% as per NMR
InChI
InChI=1S/C33H45N3O8/c1-10-18(4)29(32(39)36-28(17(2)3)33(40)44-9)35-24-14-12-21-22(16-25(24)38)23(34-19(5)37)13-11-20-15-26(41-6)30(42-7)31(43-8)27(20)21/h12,14-18,23,28-29H,10-11,13H2,1-9H3,(H,34,37)(H,35,38)(H,36,39)/t18-,23-,28-,29-/m0/s1
InChIKey
ICRHCTDRVGFDEW-GYILDLLQSA-N
Synonyms

(S)methyl2((2S3S)2(((S)7acetamido123trimethoxy9oxo5679tetrahydrobenzo(a)heptalen10yl)amino)3methylpentanamido)3methylbutanoate
110207736
CC(C@@H)((C@@H)(C(=O)N(C@H)(C(=O)OC)C(C)C)Nc1ccc2c(cc1=O)(C@H)(CCc1c2c(OC)c(c(c1)OC)OC)NC(=O)C)C
InChI=1SC33H45N3O8c11018(4)29(32(39)3628(17(2)3)33(40)449)352414122122(1625(24)38)23(3419(5)37)1311201526(416)30(427)31(438)27(20)21h121418232829H101113H219H3(H3437)(H3538)(H3639)t18232829m0s1
methyl(2~(S))2(((2~(S)3~(S))2(((7~(S))7acetamido123trimethoxy9oxo67dihydro5~(H)benzo(a)heptalen10yl)amino)3methylpentanoyl)amino)3methylbutanoate
methylN((7S)7(acetylamino)123trimethoxy9oxo5679tetrahydrobenzo(a)heptalen10yl)LisoleucylLvalinate
ZINC000253405193
ZINC253405193

Check stock

See real-time availability and sample size for STL542701 on the Vitas-M platform.

Check stock on Vitas-M

Available files

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

Download SDF Download MOL 3D structure Download SDS