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-(1-methyl-1H-pyrazol-3-yl)glycinamide
Catalog ID
STL549159
SMILES COc1c2c(CC[C@@H](c3c2ccc(c(=O)c3)NCC(=O)Nc2ccn(n2)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 C27H31N5O6 MW 521.57 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H31N5O6/c1-15(33)29-19-8-6-16-12-22(36-3)26(37-4)27(38-5)25(16)17-7-9-20(21(34)13-18(17)19)28-14-24(35)30-23-10-11-32(2)31-23/h7,9-13,19H,6,8,14H2,1-5H3,(H,28,34)(H,29,33)(H,30,31,35)/t19-/m0/s1InChIKey
AIBMJFBJOLSSER-IBGZPJMESA-NSynonyms
1676108-13-6(S)2((7acetamido123trimethoxy9oxo5679tetrahydrobenzo(a)heptalen10yl)amino)N(1methyl1Hpyrazol3yl)acetamide
100002819
1676108136
2(((7~(S))7acetamido123trimethoxy9oxo67dihydro5~(H)benzo(a)heptalen10yl)amino)~(N)(1methylpyrazol3yl)acetamide
COc1c2c(CC(C@@H)(c3c2ccc(c(=O)c3)NCC(=O)Nc2ccn(n2)C)NC(=O)C)cc(c1OC)OC
InChI=1SC27H31N5O6c115(33)291986161222(363)26(374)27(385)25(16)177920(21(34)1318(17)19)281424(35)3023101132(2)3123h791319H6814H215H3(H2834)(H2933)(H303135)t19m0s1
N~2~((7S)7(acetylamino)123trimethoxy9oxo5679tetrahydrobenzo(a)heptalen10yl)N(1methyl1Hpyrazol3yl)glycinamide
ZINC000218067892
ZINC218067892
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