Vitas-M small molecule compound
6-[(6-{[(7S)-7-(acetylamino)-1,2,3-trimethoxy-9-oxo-5,6,7,9-tetrahydrobenzo[a]heptalen-10-yl]amino}hexanoyl)amino]hexanoic acid
Catalog ID
STL543364
SMILES COc1c2c(CC[C@@H](c3c2ccc(c(=O)c3)NCCCCCC(=O)NCCCCCC(=O)O)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 C33H45N3O8 MW 611.74 g/mol Purity >90% as per NMR
InChI
InChI=1S/C33H45N3O8/c1-21(37)36-25-15-13-22-19-28(42-2)32(43-3)33(44-4)31(22)23-14-16-26(27(38)20-24(23)25)34-17-9-5-7-11-29(39)35-18-10-6-8-12-30(40)41/h14,16,19-20,25H,5-13,15,17-18H2,1-4H3,(H,34,38)(H,35,39)(H,36,37)(H,40,41)/t25-/m0/s1InChIKey
UQIPEMZYENYRFW-VWLOTQADSA-NSynonyms
1676111-48-0(S)6(6((7acetamido123trimethoxy9oxo5679tetrahydrobenzo(a)heptalen10yl)amino)hexanamido)hexanoicacid
1676111480
6((6(((7S)7(acetylamino)123trimethoxy9oxo5679tetrahydrobenzo(a)heptalen10yl)amino)hexanoyl)amino)hexanoicacid
6(6(((7~(S))7acetamido123trimethoxy9oxo67dihydro5~(H)benzo(a)heptalen10yl)amino)hexanoylamino)hexanoicacid
99999666
COc1c2c(CC(C@@H)(c3c2ccc(c(=O)c3)NCCCCCC(=O)NCCCCCC(=O)O)NC(=O)C)cc(c1OC)OC
InChI=1SC33H45N3O8c121(37)36251513221928(422)32(433)33(444)31(22)23141626(27(38)2024(23)25)34179571129(39)351810681230(40)41h1416192025H513151718H214H3(H3438)(H3539)(H3637)(H4041)t25m0s1
ZINC000217990327
ZINC217990327
Check stock
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Check stock on Vitas-MAvailable files
Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.