Vitas-M small molecule compound
4-{[(7S)-7-(acetylamino)-1,2,3-trimethoxy-9-oxo-5,6,7,9-tetrahydrobenzo[a]heptalen-10-yl]amino}-N-(furan-2-ylmethyl)butanamide
Catalog ID
STL542628
SMILES COc1c2c(CC[C@@H](c3c2ccc(c(=O)c3)NCCCC(=O)NCc2ccco2)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 C30H35N3O7 MW 549.62 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H35N3O7/c1-18(34)33-23-11-9-19-15-26(37-2)29(38-3)30(39-4)28(19)21-10-12-24(25(35)16-22(21)23)31-13-5-8-27(36)32-17-20-7-6-14-40-20/h6-7,10,12,14-16,23H,5,8-9,11,13,17H2,1-4H3,(H,31,35)(H,32,36)(H,33,34)/t23-/m0/s1InChIKey
BERLEHMIMQJYOV-QHCPKHFHSA-NSynonyms
1574342-85-0(S)4((7acetamido123trimethoxy9oxo5679tetrahydrobenzo(a)heptalen10yl)amino)N(furan2ylmethyl)butanamide
1574342850
4(((7~(S))7acetamido123trimethoxy9oxo67dihydro5~(H)benzo(a)heptalen10yl)amino)~(N)(furan2ylmethyl)butanamide
4(((7S)7(acetylamino)123trimethoxy9oxo5679tetrahydrobenzo(a)heptalen10yl)amino)N(furan2ylmethyl)butanamide
75491264
InChI=1SC30H35N3O7c118(34)3323119191526(372)29(383)30(394)28(19)21101224(25(35)1622(21)23)31135827(36)32172076144020h671012141623H589111317H214H3(H3135)(H3236)(H3334)t23m0s1
ZINC000108448152
ZINC108448152
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