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

(3S)-2-{N-[(7S)-7-(acetylamino)-1,2,3-trimethoxy-9-oxo-5,6,7,9-tetrahydrobenzo[a]heptalen-10-yl]-L-valyl}-N-methyl-1,2,3,4-tetrahydroisoquinoline-3-carboxamide

Catalog ID
STL547587
SMILES CNC(=O)[C@@H]1Cc2ccccc2CN1C(=O)[C@H](C(C)C)Nc1ccc2c(cc1=O)[C@H](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 C37H44N4O7 MW 656.78 g/mol Purity >90% as per NMR
InChI
InChI=1S/C37H44N4O7/c1-20(2)33(37(45)41-19-24-11-9-8-10-22(24)16-29(41)36(44)38-4)40-28-15-13-25-26(18-30(28)43)27(39-21(3)42)14-12-23-17-31(46-5)34(47-6)35(48-7)32(23)25/h8-11,13,15,17-18,20,27,29,33H,12,14,16,19H2,1-7H3,(H,38,44)(H,39,42)(H,40,43)/t27-,
InChIKey
JFPGPDNMQHAWII-GSZYCOFVSA-N
Synonyms

(3~(S))2((2~(S))2(((7~(S))7acetamido123trimethoxy9oxo67dihydro5~(H)benzo(a)heptalen10yl)amino)3methylbutanoyl)~(N)methyl34dihydro1~(H)isoquinoline3carboxamide
(3S)2(N((7S)7(acetylamino)123trimethoxy9oxo5679tetrahydrobenzo(a)heptalen10yl)Lvalyl)Nmethyl1234tetrahydroisoquinoline3carboxamide
(S)2((S)2(((S)7acetamido123trimethoxy9oxo5679tetrahydrobenzo(a)heptalen10yl)amino)3methylbutanoyl)Nmethyl1234tetrahydroisoquinoline3carboxamide
121541242
CNC(=O)(C@@H)1Cc2ccccc2CN1C(=O)(C@H)(C(C)C)Nc1ccc2c(cc1=O)(C@H)(CCc1c2c(OC)c(c(c1)OC)OC)NC(=O)C
InChI=1SC37H44N4O7c120(2)33(37(45)41192411981022(24)1629(41)36(44)384)402815132526(1830(28)43)27(3921(3)42)1412231731(465)34(476)35(487)32(23)25h8111315171820272933H12141619H217H3(H3844)(H3942)(H4043)t272933m0s1
ZINC000263585490
ZINC263585490

Check stock

See real-time availability and sample size for STL547587 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