Vitas-M small molecule compound
(2S,12Z,14Z,16S,17S,18R,19S,20S,21S,22R,23S,24Z)-21-(acetyloxy)-17,19-dihydroxy-23-methoxy-8-[(4-methoxyphenyl)amino]-2,4,12,16,18,20,22-heptamethyl-1,6,9,11-tetraoxo-1,2,6,9-tetrahydro-2,7-(epoxypentadeca[1,11,13]trienoimino)naphtho[2,1-b]furan-5-yl 4-me
Catalog ID
STL558175
SMILES COc1ccc(cc1)NC1=C2NC(=O)/C(=C\C=C/[C@H](C)[C@H](O)[C@@H](C)[C@H](O)[C@@H]([C@@H]([C@@H]([C@H](/C=C\O[C@@]3(C(=O)c4c(C1=O)c(C2=O)c(OC(=O)c1ccc(cc1)OC)c(c4O3)C)C)OC)C)OC(=O)C)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 C52H58N2O15 MW 951.04 g/mol Purity >90% as per NMR
InChI
InChI=1S/C52H58N2O15/c1-25-13-12-14-26(2)50(61)54-41-40(53-33-17-21-35(64-10)22-18-33)44(58)37-38(45(41)59)47(68-51(62)32-15-19-34(63-9)20-16-32)30(6)48-39(37)49(60)52(8,69-48)66-24-23-36(65-11)27(3)46(67-31(7)55)29(5)43(57)28(4)42(25)56/h12-25,27-29,36,4InChIKey
ALZRSAKATFSTFP-ACQPHLPNSA-NSynonyms
((7~(S)9~(Z)11~(S)12~(R)13~(S)14~(S)15~(S)16~(R)17~(S)18~(S)19~(Z)21~(Z))13acetyloxy1517dihydroxy11methoxy26(4methoxyanilino)371214161822heptamethyl6232729tetraoxo830dioxa24azatetracyclo(23311^(47)0^(528))triaconta135(28)9192125heptaen2yl)4methoxyben
(2S12Z14Z16S17S18R19S20S21S22R23S24Z)21(acetyloxy)1719dihydroxy23methoxy8((4methoxyphenyl)amino)241216182022heptamethyl16911tetraoxo1269tetrahydro27(epoxypentadeca(11113)trienoimino)naphtho(21b)furan5yl4me
43915167
COc1ccc(cc1)NC1=C2NC(=O)C(=CC=C(C@H)(C)(C@H)(O)(C@@H)(C)(C@H)(O)(C@@H)((C@@H)((C@@H)((C@H)(C=CO(C@@)3(C(=O)c4c(C1=O)c(C2=O)c(OC(=O)c1ccc(cc1)OC)c(c4O3)C)C)OC)C)OC(=O)C)C)C
InChI=1SC52H58N2O15c12513121426(2)50(61)544140(5333172135(6410)221833)44(58)3738(45(41)59)47(6851(62)32151934(639)201632)30(6)4839(37)49(60)52(86948)66242336(6511)27(3)46(6731(7)55)29(5)43(57)28(4)42(25)56h1225272936424346535657H111H3(H5461)b13122423
ZINC000254866153
Check stock
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