Vitas-M small molecule compound
N-[(7S)-7-(acetylamino)-1,2,3-trimethoxy-9-oxo-5,6,7,9-tetrahydrobenzo[a]heptalen-10-yl]glycylglycine
Catalog ID
STL548543
SMILES COc1c2c(CC[C@@H](c3c2ccc(c(=O)c3)NCC(=O)NCC(=O)O)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 C25H29N3O8 MW 499.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H29N3O8/c1-13(29)28-17-7-5-14-9-20(34-2)24(35-3)25(36-4)23(14)15-6-8-18(19(30)10-16(15)17)26-11-21(31)27-12-22(32)33/h6,8-10,17H,5,7,11-12H2,1-4H3,(H,26,30)(H,27,31)(H,28,29)(H,32,33)/t17-/m0/s1InChIKey
IIBLMIGPKPJJSU-KRWDZBQOSA-NSynonyms
(S)2(2((7acetamido123trimethoxy9oxo5679tetrahydrobenzo(a)heptalen10yl)amino)acetamido)aceticacid
121541995
2((2(((7~(S))7acetamido123trimethoxy9oxo67dihydro5~(H)benzo(a)heptalen10yl)amino)acetyl)amino)aceticacid
COc1c2c(CC(C@@H)(c3c2ccc(c(=O)c3)NCC(=O)NCC(=O)O)NC(=O)C)cc(c1OC)OC
InChI=1SC25H29N3O8c113(29)28177514920(342)24(353)25(364)23(14)156818(19(30)1016(15)17)261121(31)271222(32)33h681017H571112H214H3(H2630)(H2731)(H2829)(H3233)t17m0s1
N((7S)7(acetylamino)123trimethoxy9oxo5679tetrahydrobenzo(a)heptalen10yl)glycylglycine
ZINC000263585416
ZINC263585416
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