Vitas-M small molecule compound
N~2~-[(7S)-7-(acetylamino)-1,2,3-trimethoxy-9-oxo-5,6,7,9-tetrahydrobenzo[a]heptalen-10-yl]-N-[2-(1H-indol-3-yl)ethyl]-L-isoleucinamide
Catalog ID
STL542569
SMILES CC[C@H]([C@@H](C(=O)NCCc1c[nH]c2c1cccc2)Nc1ccc2c(cc1=O)[C@H](CCc1c2c(OC)c(c(c1)OC)OC)NC(=O)C)C
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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 C37H44N4O6 MW 640.78 g/mol Purity >90% as per NMR
InChI
InChI=1S/C37H44N4O6/c1-7-21(2)34(37(44)38-17-16-24-20-39-28-11-9-8-10-25(24)28)41-30-15-13-26-27(19-31(30)43)29(40-22(3)42)14-12-23-18-32(45-4)35(46-5)36(47-6)33(23)26/h8-11,13,15,18-21,29,34,39H,7,12,14,16-17H2,1-6H3,(H,38,44)(H,40,42)(H,41,43)/t21-,29+,InChIKey
UKWDIJJHSRVDCZ-NDPPAOGFSA-NSynonyms
1574344-40-3(2~(S)3~(R))2(((7~(S))7acetamido123trimethoxy9oxo67dihydro5~(H)benzo(a)heptalen10yl)amino)~(N)(2(1~(H)indol3yl)ethyl)3methylpentanamide
(2S3R)N(2(1Hindol3yl)ethyl)2(((S)7acetamido123trimethoxy9oxo5679tetrahydrobenzo(a)heptalen10yl)amino)3methylpentanamide
1574344403
75491864
CC(C@H)((C@@H)(C(=O)NCCc1c(nH)c2c1cccc2)Nc1ccc2c(cc1=O)(C@H)(CCc1c2c(OC)c(c(c1)OC)OC)NC(=O)C)C
InChI=1SC37H44N4O6c1721(2)34(37(44)3817162420392811981025(24)28)413015132627(1931(30)43)29(4022(3)42)1412231832(454)35(465)36(476)33(23)26h81113151821293439H712141617H216H3(H3844)(H4042)(H4143)t2129+34+m1s1
N~2~((7S)7(acetylamino)123trimethoxy9oxo5679tetrahydrobenzo(a)heptalen10yl)N(2(1Hindol3yl)ethyl)Lisoleucinamide
ZINC000108449727
ZINC108449727
Check stock
See real-time availability and sample size for STL542569 on the Vitas-M platform.
Check stock on Vitas-MAvailable files
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