Vitas-M small molecule compound
4-{[(7S)-7-(acetylamino)-1,2,3-trimethoxy-9-oxo-5,6,7,9-tetrahydrobenzo[a]heptalen-10-yl]amino}-N-[2-(cyclohex-1-en-1-yl)ethyl]butanamide
Catalog ID
STL540549
SMILES COc1c2c(CC[C@@H](c3c2ccc(c(=O)c3)NCCCC(=O)NCCC2=CCCCC2)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 C33H43N3O6 MW 577.72 g/mol Purity >90% as per NMR
InChI
InChI=1S/C33H43N3O6/c1-21(37)36-26-14-12-23-19-29(40-2)32(41-3)33(42-4)31(23)24-13-15-27(28(38)20-25(24)26)34-17-8-11-30(39)35-18-16-22-9-6-5-7-10-22/h9,13,15,19-20,26H,5-8,10-12,14,16-18H2,1-4H3,(H,34,38)(H,35,39)(H,36,37)/t26-/m0/s1InChIKey
HYONKAXWLIIRIN-SANMLTNESA-NSynonyms
1574379-81-9(S)4((7acetamido123trimethoxy9oxo5679tetrahydrobenzo(a)heptalen10yl)amino)N(2(cyclohex1en1yl)ethyl)butanamide
1574379819
4(((7~(S))7acetamido123trimethoxy9oxo67dihydro5~(H)benzo(a)heptalen10yl)amino)~(N)(2(cyclohexen1yl)ethyl)butanamide
4(((7S)7(acetylamino)123trimethoxy9oxo5679tetrahydrobenzo(a)heptalen10yl)amino)N(2(cyclohex1en1yl)ethyl)butanamide
75492042
COc1c2c(CC(C@@H)(c3c2ccc(c(=O)c3)NCCCC(=O)NCCC2=CCCCC2)NC(=O)C)cc(c1OC)OC
InChI=1SC33H43N3O6c121(37)36261412231929(402)32(413)33(424)31(23)24131527(28(38)2025(24)26)341781130(39)3518162296571022h91315192026H581012141618H214H3(H3438)(H3539)(H3637)t26m0s1
ZINC000108450167
ZINC108450167
Check stock
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Check stock on Vitas-MAvailable files
Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.