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(7S,9E,11S,12R,13R,14S,15S,19S,20S,21E,23Z,32R)-28-(cyclopropylamino)-2-hydroxy-11-methoxy-3,7,12,14,17,17,20,24,32-nonamethyl-6,25,29,31-tetraoxo-8,16,18,33-tetraoxa-26-azapentacyclo[25.3.1.1~4,7~.1~15,19~.0~5,30~]tritriaconta-1(30),2,4,9,21,23,27-heptae

Catalog ID
STL558198
SMILES CO[C@H]1/C=C/O[C@@]2(C)Oc3c(C2=O)c2C(=O)C(=C(C(=O)c2c(c3C)O)NC(=O)/C(=C\C=C\[C@@H]([C@H]2[C@H]([C@H]([C@@H]([C@@H]([C@@H]1C)OC(=O)C)C)OC(C)(C)O2)C)C)/C)NC1CC1

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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 C43H54N2O12 MW 790.91 g/mol Purity >90% as per NMR
InChI
InChI=1S/C43H54N2O12/c1-19-13-12-14-20(2)41(51)45-32-31(44-26-15-16-26)34(48)28-29(35(32)49)33(47)22(4)39-30(28)40(50)43(10,57-39)53-18-17-27(52-11)21(3)37(54-25(7)46)24(6)38-23(5)36(19)55-42(8,9)56-38/h12-14,17-19,21,23-24,26-27,36-38,44,47H,15-16H2,1-11
InChIKey
MPGGPTSGIYWEOI-JHOOTERJSA-N
Synonyms

((7~(S)9~(E)11~(S)12~(R)13~(R)14~(S)15~(S)19~(S)20~(S)21~(E)23~(Z)32~(R))28(cyclopropylamino)2hydroxy11methoxy3712141717202432nonamethyl6252931tetraoxo8161833tetraoxa26azapentacyclo(25311^(47)1^(1519)0^(530))tritriaconta1(30)249212327heptaen13yl)acet
(7S9E11S12R13R14S15S19S20S21E23Z32R)28(cyclopropylamino)2hydroxy11methoxy3712141717202432nonamethyl6252931tetraoxo8161833tetraoxa26azapentacyclo(25311~47~1~1519~0~530~)tritriaconta1(30)249212327heptae
16398469
CO(C@H)1C=CO(C@@)2(C)Oc3c(C2=O)c2C(=O)C(=C(C(=O)c2c(c3C)O)NC(=O)C(=CC=C(C@@H)((C@H)2(C@H)((C@@H)((C@@H)((C@@H)((C@@H)1C)OC(=O)C)C)OC(C)(C)O2)C)C)C)NC1CC1
InChI=1SC43H54N2O12c11913121420(2)41(51)453231(4426151626)34(48)2829(35(32)49)33(47)22(4)3930(28)40(50)43(105739)53181727(5211)21(3)37(5425(7)46)24(6)3823(5)36(19)5542(89)5638h12141719212324262736384447H1516H2111H3(H4551)b1312+1817+2014t1921+23+24+27
MFCD03849887
ZINC000254743093
ZINC245240178

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Available files

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