Vitas-M small molecule compound
6-({N-[(7S)-7-(acetylamino)-1,2,3-trimethoxy-9-oxo-5,6,7,9-tetrahydrobenzo[a]heptalen-10-yl]-L-valyl}amino)hexanoic acid
Catalog ID
STL545670
SMILES COc1c2c(CC[C@@H](c3c2ccc(c(=O)c3)N[C@H](C(=O)NCCCCCC(=O)O)C(C)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 C32H43N3O8 MW 597.71 g/mol Purity >90% as per NMR
InChI
InChI=1S/C32H43N3O8/c1-18(2)29(32(40)33-15-9-7-8-10-27(38)39)35-24-14-12-21-22(17-25(24)37)23(34-19(3)36)13-11-20-16-26(41-4)30(42-5)31(43-6)28(20)21/h12,14,16-18,23,29H,7-11,13,15H2,1-6H3,(H,33,40)(H,34,36)(H,35,37)(H,38,39)/t23-,29-/m0/s1InChIKey
QOJKDPAYMLCKOV-IADCTJSHSA-NSynonyms
110206131
6(((2~(S))2(((7~(S))7acetamido123trimethoxy9oxo67dihydro5~(H)benzo(a)heptalen10yl)amino)3methylbutanoyl)amino)hexanoicacid
6((N((7S)7(acetylamino)123trimethoxy9oxo5679tetrahydrobenzo(a)heptalen10yl)Lvalyl)amino)hexanoicacid
6((S)2(((S)7acetamido123trimethoxy9oxo5679tetrahydrobenzo(a)heptalen10yl)amino)3methylbutanamido)hexanoicacid
COc1c2c(CC(C@@H)(c3c2ccc(c(=O)c3)N(C@H)(C(=O)NCCCCCC(=O)O)C(C)C)NC(=O)C)cc(c1OC)OC
InChI=1SC32H43N3O8c118(2)29(32(40)33159781027(38)39)352414122122(1725(24)37)23(3419(3)36)1311201626(414)30(425)31(436)28(20)21h121416182329H7111315H216H3(H3340)(H3436)(H3537)(H3839)t2329m0s1
ZINC000253412305
ZINC253412305
Check stock
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Check stock on Vitas-MAvailable files
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