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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-(2-methoxybenzyl)-L-leucinamide

Catalog ID
STL541174
SMILES COc1c(OC)cc2c(c1OC)c1ccc(c(=O)cc1[C@H](CC2)NC(=O)C)N[C@H](C(=O)NCc1ccccc1OC)CC(C)C

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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 C35H43N3O7 MW 617.74 g/mol Purity >90% as per NMR
InChI
InChI=1S/C35H43N3O7/c1-20(2)16-28(35(41)36-19-23-10-8-9-11-30(23)42-4)38-27-15-13-24-25(18-29(27)40)26(37-21(3)39)14-12-22-17-31(43-5)33(44-6)34(45-7)32(22)24/h8-11,13,15,17-18,20,26,28H,12,14,16,19H2,1-7H3,(H,36,41)(H,37,39)(H,38,40)/t26-,28-/m0/s1
InChIKey
BHFWMCQUWFCDOS-XCZPVHLTSA-N
Synonyms
1574354-76-9
(2~(S))2(((7~(S))7acetamido123trimethoxy9oxo67dihydro5~(H)benzo(a)heptalen10yl)amino)~(N)((2methoxyphenyl)methyl)4methylpentanamide
(S)2(((S)7acetamido123trimethoxy9oxo5679tetrahydrobenzo(a)heptalen10yl)amino)N(2methoxybenzyl)4methylpentanamide
1574354769
75492063
COc1c(OC)cc2c(c1OC)c1ccc(c(=O)cc1(C@H)(CC2)NC(=O)C)N(C@H)(C(=O)NCc1ccccc1OC)CC(C)C
InChI=1SC35H43N3O7c120(2)1628(35(41)36192310891130(23)424)382715132425(1829(27)40)26(3721(3)39)1412221731(435)33(446)34(457)32(22)24h81113151718202628H12141619H217H3(H3641)(H3739)(H3840)t2628m0s1
N~2~((7S)7(acetylamino)123trimethoxy9oxo5679tetrahydrobenzo(a)heptalen10yl)N(2methoxybenzyl)Lleucinamide
ZINC000108450212
ZINC108450212

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Available files

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

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