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-prop-2-en-1-yl-L-isoleucinamide
Catalog ID
STL541329
SMILES C=CCNC(=O)[C@H]([C@@H](CC)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 C30H39N3O6 MW 537.66 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H39N3O6/c1-8-14-31-30(36)27(17(3)9-2)33-23-13-11-20-21(16-24(23)35)22(32-18(4)34)12-10-19-15-25(37-5)28(38-6)29(39-7)26(19)20/h8,11,13,15-17,22,27H,1,9-10,12,14H2,2-7H3,(H,31,36)(H,32,34)(H,33,35)/t17-,22+,27+/m1/s1InChIKey
IGHQVECGXCGRKN-DCMIEBIUSA-NSynonyms
1574292-07-1(2~(S)3~(R))2(((7~(S))7acetamido123trimethoxy9oxo67dihydro5~(H)benzo(a)heptalen10yl)amino)3methyl~(N)prop2enylpentanamide
(2S3R)2(((S)7acetamido123trimethoxy9oxo5679tetrahydrobenzo(a)heptalen10yl)amino)Nallyl3methylpentanamide
1574292071
75491797
C=CCNC(=O)(C@H)((C@@H)(CC)C)Nc1ccc2c(cc1=O)(C@H)(CCc1c2c(OC)c(c(c1)OC)OC)NC(=O)C
InChI=1SC30H39N3O6c18143130(36)27(17(3)92)332313112021(1624(23)35)22(3218(4)34)1210191525(375)28(386)29(397)26(19)20h8111315172227H19101214H227H3(H3136)(H3234)(H3335)t1722+27+m1s1
N~2~((7S)7(acetylamino)123trimethoxy9oxo5679tetrahydrobenzo(a)heptalen10yl)Nprop2en1ylLisoleucinamide
ZINC000108449568
ZINC108449568
Check stock
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Check stock on Vitas-MAvailable files
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