Vitas-M small molecule compound
tert-butyl (1-{N-[(7S)-7-(acetylamino)-1,2,3-trimethoxy-9-oxo-5,6,7,9-tetrahydrobenzo[a]heptalen-10-yl]-L-isoleucyl}piperidin-4-yl)carbamate
Catalog ID
STL541712
SMILES CC[C@H]([C@@H](C(=O)N1CCC(CC1)NC(=O)OC(C)(C)C)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 C37H52N4O8 MW 680.84 g/mol Purity >90% as per NMR
InChI
InChI=1S/C37H52N4O8/c1-10-21(2)32(35(44)41-17-15-24(16-18-41)39-36(45)49-37(4,5)6)40-28-14-12-25-26(20-29(28)43)27(38-22(3)42)13-11-23-19-30(46-7)33(47-8)34(48-9)31(23)25/h12,14,19-21,24,27,32H,10-11,13,15-18H2,1-9H3,(H,38,42)(H,39,45)(H,40,43)/t21-,27+,3InChIKey
FCPYAOYFEWHACB-BBQOZMKKSA-NSynonyms
1574391-07-3~(tert)butyl~(N)(1((2~(S)3~(R))2(((7~(S))7acetamido123trimethoxy9oxo67dihydro5~(H)benzo(a)heptalen10yl)amino)3methylpentanoyl)piperidin4yl)carbamate
1574391073
75492432
CC(C@H)((C@@H)(C(=O)N1CCC(CC1)NC(=O)OC(C)(C)C)Nc1ccc2c(cc1=O)(C@H)(CCc1c2c(OC)c(c(c1)OC)OC)NC(=O)C)C
InChI=1SC37H52N4O8c11021(2)32(35(44)41171524(161841)3936(45)4937(45)6)402814122526(2029(28)43)27(3822(3)42)1311231930(467)33(478)34(489)31(23)25h12141921242732H1011131518H219H3(H3842)(H3945)(H4043)t2127+32+m1s1
tertbutyl(1((2S3R)2(((S)7acetamido123trimethoxy9oxo5679tetrahydrobenzo(a)heptalen10yl)amino)3methylpentanoyl)piperidin4yl)carbamate
tertbutyl(1(N((7S)7(acetylamino)123trimethoxy9oxo5679tetrahydrobenzo(a)heptalen10yl)Lisoleucyl)piperidin4yl)carbamate
ZINC000150653806
ZINC150653806
Check stock
See real-time availability and sample size for STL541712 on the Vitas-M platform.
Check stock on Vitas-MAvailable files
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