Vitas-M small molecule compound
(2S,12Z,14Z,16S,17S,18R,19S,20S,21S,22R,23S,24Z)-21-(acetyloxy)-17,19-dihydroxy-23-methoxy-2,4,12,16,18,20,22-heptamethyl-1,6,9,11-tetraoxo-8-(pyrrolidin-1-yl)-1,2,6,9-tetrahydro-2,7-(epoxypentadeca[1,11,13]trienoimino)naphtho[2,1-b]furan-5-yl 2-methylpro
Catalog ID
STL558184
SMILES CO[C@H]1/C=C\O[C@@]2(C)Oc3c(C2=O)c2C(=O)C(=C(C(=O)c2c(c3C)OC(=O)C(C)C)NC(=O)/C(=C\C=C/[C@@H]([C@@H]([C@H]([C@@H]([C@@H]([C@@H]([C@@H]1C)OC(=O)C)C)O)C)O)C)/C)N1CCCC1
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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 C45H58N2O13 MW 834.96 g/mol Purity >90% as per NMR
InChI
InChI=1S/C45H58N2O13/c1-21(2)44(55)59-40-27(8)41-32-30-31(40)37(51)33(34(38(30)52)47-18-12-13-19-47)46-43(54)23(4)16-14-15-22(3)35(49)25(6)36(50)26(7)39(58-28(9)48)24(5)29(56-11)17-20-57-45(10,60-41)42(32)53/h14-17,20-22,24-26,29,35-36,39,49-50H,12-13,18-InChIKey
ZUADJZOWTIKNGE-FURVVNNFSA-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))13acetyloxy1517dihydroxy11methoxy371214161822heptamethyl6232729tetraoxo26pyrrolidin1yl830dioxa24azatetracyclo(23311^(47)0^(528))triaconta135(28)9192125heptaen2yl)2methylpropanoa
(2S12Z14Z16S17S18R19S20S21S22R23S24Z)21(acetyloxy)1719dihydroxy23methoxy241216182022heptamethyl16911tetraoxo8(pyrrolidin1yl)1269tetrahydro27(epoxypentadeca(11113)trienoimino)naphtho(21b)furan5yl2methylpro
43915177
CO(C@H)1C=CO(C@@)2(C)Oc3c(C2=O)c2C(=O)C(=C(C(=O)c2c(c3C)OC(=O)C(C)C)NC(=O)C(=CC=C(C@@H)((C@@H)((C@H)((C@@H)((C@@H)((C@@H)((C@@H)1C)OC(=O)C)C)O)C)O)C)C)N1CCCC1
InChI=1SC45H58N2O13c121(2)44(55)594027(8)41323031(40)37(51)33(34(38(30)52)471812131947)4643(54)23(4)16141522(3)35(49)25(6)36(50)26(7)39(5828(9)48)24(5)29(5611)17205745(106041)42(32)53h141720222426293536394950H12131819H2111H3(H4654)b151420172316t2224+
ZINC000254488033
Check stock
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