Vitas-M small molecule compound

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

Catalog ID
STL543952
SMILES COc1c2c(CC[C@@H](c3c2ccc(c(=O)c3)N[C@H](C(=O)NCc2ccco2)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 C29H33N3O7 MW 535.60 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H33N3O7/c1-16(29(35)30-15-19-7-6-12-39-19)31-23-11-9-20-21(14-24(23)34)22(32-17(2)33)10-8-18-13-25(36-3)27(37-4)28(38-5)26(18)20/h6-7,9,11-14,16,22H,8,10,15H2,1-5H3,(H,30,35)(H,31,34)(H,32,33)/t16-,22-/m0/s1
InChIKey
MEWLXKRAPPNILA-AOMKIAJQSA-N
Synonyms
1574377-03-9
(2~(S))2(((7~(S))7acetamido123trimethoxy9oxo67dihydro5~(H)benzo(a)heptalen10yl)amino)~(N)(furan2ylmethyl)propanamide
(S)2(((S)7acetamido123trimethoxy9oxo5679tetrahydrobenzo(a)heptalen10yl)amino)N(furan2ylmethyl)propanamide
1574377039
75491847
COc1c2c(CC(C@@H)(c3c2ccc(c(=O)c3)N(C@H)(C(=O)NCc2ccco2)C)NC(=O)C)cc(c1OC)OC
InChI=1SC29H33N3O7c116(29(35)30151976123919)31231192021(1424(23)34)22(3217(2)33)108181325(363)27(374)28(385)26(18)20h67911141622H81015H215H3(H3035)(H3134)(H3233)t1622m0s1
N~2~((7S)7(acetylamino)123trimethoxy9oxo5679tetrahydrobenzo(a)heptalen10yl)N(furan2ylmethyl)Lalaninamide
ZINC000108449691
ZINC108449691

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Available files

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