Vitas-M small molecule compound

N-{(7S)-1,2,3-trimethoxy-9-oxo-10-[(3,4,5-trimethoxybenzyl)amino]-5,6,7,9-tetrahydrobenzo[a]heptalen-7-yl}acetamide

Catalog ID
STL524663
SMILES COc1c(OC)cc2c(c1OC)c1ccc(c(=O)cc1[C@H](CC2)NC(=O)C)NCc1cc(OC)c(c(c1)OC)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 C31H36N2O8 MW 564.64 g/mol Purity >90% as per NMR
InChI
InChI=1S/C31H36N2O8/c1-17(34)33-22-10-8-19-14-27(38-4)30(40-6)31(41-7)28(19)20-9-11-23(24(35)15-21(20)22)32-16-18-12-25(36-2)29(39-5)26(13-18)37-3/h9,11-15,22H,8,10,16H2,1-7H3,(H,32,35)(H,33,34)/t22-/m0/s1
InChIKey
ZNQPELKAXXCDQN-QFIPXVFZSA-N
Synonyms
308836-66-0
(S)N(123trimethoxy9oxo10((345trimethoxybenzyl)amino)5679tetrahydrobenzo(a)heptalen7yl)acetamide
~(N)((7~(S))123trimethoxy9oxo10((345trimethoxyphenyl)methylamino)67dihydro5~(H)benzo(a)heptalen7yl)acetamide
308836660
6567859
COc1c(OC)cc2c(c1OC)c1ccc(c(=O)cc1(C@H)(CC2)NC(=O)C)NCc1cc(OC)c(c(c1)OC)OC
InChI=1SC31H36N2O8c117(34)3322108191427(384)30(406)31(417)28(19)2091123(24(35)1521(20)22)3216181225(362)29(395)26(1318)373h9111522H81016H217H3(H3235)(H3334)t22m0s1
MFCD01543261
N((7S)123trimethoxy9oxo10((345trimethoxybenzyl)amino)5679tetrahydrobenzo(a)heptalen7yl)acetamide
N((7S)123TRIMETHOXY9OXO10((345TRIMETHOXYPHENYL)METHYLAMINO)67DIHYDRO5HBENZO(A)HEPTALEN7YL)ACETAMIDE
ZINC000070664494
ZINC70664494

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Available files

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