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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-ethylpyrrolidin-2-yl)methyl]-L-valinamide

Catalog ID
STL541607
SMILES CCN1CCCC1CNC(=O)[C@H](C(C)C)Nc1ccc2c(cc1=O)[C@H](CCc1c2c(OC)c(c(c1)OC)OC)NC(=O)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 C33H46N4O6 MW 594.75 g/mol Purity >90% as per NMR
InChI
InChI=1S/C33H46N4O6/c1-8-37-15-9-10-22(37)18-34-33(40)30(19(2)3)36-26-14-12-23-24(17-27(26)39)25(35-20(4)38)13-11-21-16-28(41-5)31(42-6)32(43-7)29(21)23/h12,14,16-17,19,22,25,30H,8-11,13,15,18H2,1-7H3,(H,34,40)(H,35,38)(H,36,39)/t22?,25-,30-/m0/s1
InChIKey
CVOPJGXEVFAMOX-POVIAMFCSA-N
Synonyms
1574252-49-5
(2~(S))2(((7~(S))7acetamido123trimethoxy9oxo67dihydro5~(H)benzo(a)heptalen10yl)amino)~(N)((1ethylpyrrolidin2yl)methyl)3methylbutanamide
(2S)2(((S)7acetamido123trimethoxy9oxo5679tetrahydrobenzo(a)heptalen10yl)amino)N((1ethylpyrrolidin2yl)methyl)3methylbutanamide
1574252495
75491826
CCN1CCCC1CNC(=O)(C@H)(C(C)C)Nc1ccc2c(cc1=O)(C@H)(CCc1c2c(OC)c(c(c1)OC)OC)NC(=O)C
InChI=1SC33H46N4O6c18371591022(37)183433(40)30(19(2)3)362614122324(1727(26)39)25(3520(4)38)1311211628(415)31(426)32(437)29(21)23h1214161719222530H811131518H217H3(H3440)(H3538)(H3639)t22?2530m0s1
N~2~((7S)7(acetylamino)123trimethoxy9oxo5679tetrahydrobenzo(a)heptalen10yl)N((1ethylpyrrolidin2yl)methyl)Lvalinamide
ZINC000108449647
ZINC000108449650

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Available files

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