Vitas-M small molecule compound
N-[(7S)-10-({4-[2-(2,4-dimethoxyphenyl)pyrrolidin-1-yl]-4-oxobutyl}amino)-1,2,3-trimethoxy-9-oxo-5,6,7,9-tetrahydrobenzo[a]heptalen-7-yl]acetamide
Catalog ID
STL548233
SMILES COc1ccc(c(c1)OC)C1CCCN1C(=O)CCCNc1ccc2c(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 C37H45N3O8 MW 659.78 g/mol Purity >90% as per NMR
InChI
InChI=1S/C37H45N3O8/c1-22(41)39-28-15-11-23-19-33(46-4)36(47-5)37(48-6)35(23)25-14-16-29(31(42)21-27(25)28)38-17-7-10-34(43)40-18-8-9-30(40)26-13-12-24(44-2)20-32(26)45-3/h12-14,16,19-21,28,30H,7-11,15,17-18H2,1-6H3,(H,38,42)(H,39,41)/t28-,30?/m0/s1InChIKey
HIBXJCCLGDSPIV-MBCWZBCWSA-NSynonyms
~(N)((7~(S))10((4(2(24dimethoxyphenyl)pyrrolidin1yl)4oxobutyl)amino)123trimethoxy9oxo67dihydro5~(H)benzo(a)heptalen7yl)acetamide
110208096
COc1ccc(c(c1)OC)C1CCCN1C(=O)CCCNc1ccc2c(cc1=O)(C@H)(CCc1c2c(OC)c(c(c1)OC)OC)NC(=O)C
InChI=1SC37H45N3O8c122(41)39281511231933(464)36(475)37(486)35(23)25141629(31(42)2127(25)28)381771034(43)40188930(40)26131224(442)2032(26)453h12141619212830H711151718H216H3(H3842)(H3941)t2830?m0s1
N((7S)10((4(2(24dimethoxyphenyl)pyrrolidin1yl)4oxobutyl)amino)123trimethoxy9oxo5679tetrahydrobenzo(a)heptalen7yl)acetamide
ZINC000253403681
ZINC000253403685
Check stock
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