Vitas-M small molecule compound
6-{[(7S)-7-(acetylamino)-1,2,3-trimethoxy-9-oxo-5,6,7,9-tetrahydrobenzo[a]heptalen-10-yl]amino}-N-[2-(pyrimidin-2-ylamino)ethyl]hexanamide
Catalog ID
STL546064
SMILES COc1c2c(CC[C@@H](c3c2ccc(c(=O)c3)NCCCCCC(=O)NCCNc2ncccn2)NC(=O)C)cc(c1OC)OC
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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 C33H42N6O6 MW 618.73 g/mol Purity >90% as per NMR
InChI
InChI=1S/C33H42N6O6/c1-21(40)39-25-12-10-22-19-28(43-2)31(44-3)32(45-4)30(22)23-11-13-26(27(41)20-24(23)25)34-14-7-5-6-9-29(42)35-17-18-38-33-36-15-8-16-37-33/h8,11,13,15-16,19-20,25H,5-7,9-10,12,14,17-18H2,1-4H3,(H,34,41)(H,35,42)(H,39,40)(H,36,37,38)/t2InChIKey
YPJXFJMMSIVMJS-VWLOTQADSA-NSynonyms
(S)6((7acetamido123trimethoxy9oxo5679tetrahydrobenzo(a)heptalen10yl)amino)N(2(pyrimidin2ylamino)ethyl)hexanamide
110205919
6(((7~(S))7acetamido123trimethoxy9oxo67dihydro5~(H)benzo(a)heptalen10yl)amino)~(N)(2(pyrimidin2ylamino)ethyl)hexanamide
6(((7S)7(acetylamino)123trimethoxy9oxo5679tetrahydrobenzo(a)heptalen10yl)amino)N(2(pyrimidin2ylamino)ethyl)hexanamide
COc1c2c(CC(C@@H)(c3c2ccc(c(=O)c3)NCCCCCC(=O)NCCNc2ncccn2)NC(=O)C)cc(c1OC)OC
InChI=1SC33H42N6O6c121(40)39251210221928(432)31(443)32(454)30(22)23111326(27(41)2024(23)25)3414756929(42)351718383336158163733h811131516192025H5791012141718H214H3(H3441)(H3542)(H3940)(H363738)t25m0s1
ZINC000253414787
ZINC253414787
Check stock
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Check stock on Vitas-MAvailable files
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