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(3R,4S,6R)-4-(dimethylamino)-2-{[(3R,4S,5S,6R,9R,11R,12R,13S,14R)-14-ethyl-7,12,13-trihydroxy-4-{[(4S,5R,6R)-5-hydroxy-4-methoxy-4,6-dimethyltetrahydro-2H-pyran-2-yl]oxy}-3,5,7,9,11,13-hexamethyl-2,10-dioxooxacyclotetradecan-6-yl]oxy}-6-methyltetrahydro-2

Catalog ID
STL564777
SMILES CCC(=O)OCCC(=O)O[C@H]1C(O[C@@H](C[C@@H]1N(C)C)C)O[C@@H]1[C@H](C)[C@H](OC2O[C@H](C)[C@H]([C@@](C2)(C)OC)O)[C@@H](C)C(=O)O[C@H](CC)[C@@]([C@H]([C@H](C(=O)[C@@H](C[C@@]1(C)O)C)C)O)(C)O

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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 C43H75NO16 MW 862.07 g/mol Purity >90% as per NMR
InChI
InChI=1S/C43H75NO16/c1-15-29-43(11,52)36(48)24(5)33(47)22(3)20-41(9,51)38(25(6)34(26(7)39(50)57-29)59-32-21-42(10,53-14)37(49)27(8)56-32)60-40-35(28(44(12)13)19-23(4)55-40)58-31(46)17-18-54-30(45)16-2/h22-29,32,34-38,40,48-49,51-52H,15-21H2,1-14H3/t22-,23
InChIKey
OZJXTWMDBPQRGI-FDUVZASOSA-N
Synonyms

((3R4S6R)4(dimethylamino)2(((3R4S5S6R7R9R11R12R13S14R)14ethyl71213trihydroxy4((4S5R6R)5hydroxy4methoxy46dimethyloxan2yl)oxy35791113hexamethyl210dioxooxacyclotetradec6yl)oxy)6methyloxan3yl)3propanoyloxypropanoate
(3R4S6R)4(dimethylamino)2(((3R4S5S6R9R11R12R13S14R)14ethyl71213trihydroxy4(((4S5R6R)5hydroxy4methoxy46dimethyltetrahydro2Hpyran2yl)oxy)35791113hexamethyl210dioxooxacyclotetradecan6yl)oxy)6methyltetrahydro2
131664510
CCC(=O)OCCC(=O)O(C@H)1C(O(C@@H)(C(C@@H)1N(C)C)C)O(C@@H)1(C@@H)(C)(C@H)(OC2O(C@H)(C)(C@H)((C@@)(C2)(C)OC)O)(C@@H)(C)C(=O)O(C@H)(CC)(C@@)((C@@H)((C@H)(C(=O)(C@@H)(C(C@@)1(C)O)C)C)O)(C)O
InChI=1SC43H75NO16c1152943(1152)36(48)24(5)33(47)22(3)2041(951)38(25(6)34(26(7)39(50)5729)59322142(105314)37(49)27(8)5632)604035(28(44(12)13)1923(4)5540)5831(46)17185430(45)162h22293234384048495152H1521H2114H3t222324+25+262728+2932?34+3536373840?4142
MFCD32651561
ZINC000253487728
ZINC001547138066

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Available files

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