Vitas-M small molecule compound
(5aS,6R,12S)-3,6,9-trimethyldecahydro-3,12-epoxy[1,2]dioxepino[4,3-i]isochromen-10-yl 4-[(1-hydroxy-2-methylpropan-2-yl)amino]-4-oxobutanoate
Catalog ID
STL533225
SMILES OCC(NC(=O)CCC(=O)OC1O[C@H]2OC3(C)CC[C@@H]4C2(C(C1C)CC[C@H]4C)OO3)(C)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 C23H37NO8 MW 455.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H37NO8/c1-13-6-7-16-14(2)19(28-18(27)9-8-17(26)24-21(3,4)12-25)29-20-23(16)15(13)10-11-22(5,30-20)31-32-23/h13-16,19-20,25H,6-12H2,1-5H3,(H,24,26)/t13-,14?,15+,16?,19?,20+,22?,23?/m1/s1InChIKey
JQUKZDZVFSIJPC-IFHAOTGOSA-NSynonyms
((4~(S)5~(R)12~(S))159trimethyl11141516tetraoxatetracyclo(10310^(413)0^(813))hexadecan10yl)4((1hydroxy2methylpropan2yl)amino)4oxobutanoate
(5aS6R12S)369trimethyldecahydro312epoxy(12)dioxepino(43i)isochromen10yl4((1hydroxy2methylpropan2yl)amino)4oxobutanoate
(5aS6R12S)369trimethyldecahydro3H312epoxy(12)dioxepino(43i)isochromen10yl4((1hydroxy2methylpropan2yl)amino)4oxobutanoate
16404087
InChI=1SC23H37NO8c113671614(2)19(2818(27)9817(26)2421(34)1225)292023(16)15(13)101122(53020)313223h1316192025H612H215H3(H2426)t1314?15+16?19?20+22?23?m1s1
MFCD06766096
OCC(NC(=O)CCC(=O)OC1O(C@H)2OC3(C)CC(C@@H)4C2(C(C1C)CC(C@H)4C)OO3)(C)C
ZINC000229781608
ZINC000229932469
Check stock
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