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N~2~-[(7S)-7-(acetylamino)-1,2,3-trimethoxy-9-oxo-5,6,7,9-tetrahydrobenzo[a]heptalen-10-yl]-N-(4-carbamoylphenyl)-L-leucinamide

Catalog ID
STL540225
SMILES COc1c2c(CC[C@@H](c3c2ccc(c(=O)c3)N[C@H](C(=O)Nc2ccc(cc2)C(=O)N)CC(C)C)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 C34H40N4O7 MW 616.71 g/mol Purity >90% as per NMR
InChI
InChI=1S/C34H40N4O7/c1-18(2)15-27(34(42)37-22-10-7-20(8-11-22)33(35)41)38-26-14-12-23-24(17-28(26)40)25(36-19(3)39)13-9-21-16-29(43-4)31(44-5)32(45-6)30(21)23/h7-8,10-12,14,16-18,25,27H,9,13,15H2,1-6H3,(H2,35,41)(H,36,39)(H,37,42)(H,38,40)/t25-,27-/m0/s1
InChIKey
WLFJCUDYIKHGJQ-BDYUSTAISA-N
Synonyms

4(((2~(S))2(((7~(S))7acetamido123trimethoxy9oxo67dihydro5~(H)benzo(a)heptalen10yl)amino)4methylpentanoyl)amino)benzamide
4((S)2(((S)7acetamido123trimethoxy9oxo5679tetrahydrobenzo(a)heptalen10yl)amino)4methylpentanamido)benzamide
91638121
COc1c2c(CC(C@@H)(c3c2ccc(c(=O)c3)N(C@H)(C(=O)Nc2ccc(cc2)C(=O)N)CC(C)C)NC(=O)C)cc(c1OC)OC
InChI=1SC34H40N4O7c118(2)1527(34(42)372210720(81122)33(35)41)382614122324(1728(26)40)25(3619(3)39)139211629(434)31(445)32(456)30(21)23h7810121416182527H91315H216H3(H23541)(H3639)(H3742)(H3840)t2527m0s1
N~2~((7S)7(acetylamino)123trimethoxy9oxo5679tetrahydrobenzo(a)heptalen10yl)N(4carbamoylphenyl)Lleucinamide
ZINC000217849786
ZINC217849786

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.

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