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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-[(1-methyl-1H-indol-3-yl)methyl]-L-alaninamide

Catalog ID
STL544795
SMILES COc1c2c(CC[C@@H](c3c2ccc(c(=O)c3)N[C@H](C(=O)NCc2cn(c3c2cccc3)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 C34H38N4O6 MW 598.70 g/mol Purity >90% as per NMR
InChI
InChI=1S/C34H38N4O6/c1-19(34(41)35-17-22-18-38(3)28-10-8-7-9-23(22)28)36-27-14-12-24-25(16-29(27)40)26(37-20(2)39)13-11-21-15-30(42-4)32(43-5)33(44-6)31(21)24/h7-10,12,14-16,18-19,26H,11,13,17H2,1-6H3,(H,35,41)(H,36,40)(H,37,39)/t19-,26-/m0/s1
InChIKey
YVQYHGKZBRIXSV-SIBVEZHUSA-N
Synonyms

(2~(S))2(((7~(S))7acetamido123trimethoxy9oxo67dihydro5~(H)benzo(a)heptalen10yl)amino)~(N)((1methylindol3yl)methyl)propanamide
(S)2(((S)7acetamido123trimethoxy9oxo5679tetrahydrobenzo(a)heptalen10yl)amino)N((1methyl1Hindol3yl)methyl)propanamide
110206250
COc1c2c(CC(C@@H)(c3c2ccc(c(=O)c3)N(C@H)(C(=O)NCc2cn(c3c2cccc3)C)C)NC(=O)C)cc(c1OC)OC
InChI=1SC34H38N4O6c119(34(41)3517221838(3)281087923(22)28)362714122425(1629(27)40)26(3720(2)39)1311211530(424)32(435)33(446)31(21)24h710121416181926H111317H216H3(H3541)(H3640)(H3739)t1926m0s1
N~2~((7S)7(acetylamino)123trimethoxy9oxo5679tetrahydrobenzo(a)heptalen10yl)N((1methyl1Hindol3yl)methyl)Lalaninamide
ZINC000253414867
ZINC253414867

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Available files

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

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