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

Catalog ID
STL553295
SMILES CCC(=O)OC1[C@@H](OC(CC1N(C)C)C)O[C@H]1[C@H](C)[C@@H](O[C@@H]2CC(OC)[C@@H](C(O2)C)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 C39H69NO14 MW 775.98 g/mol Purity >90% as per NMR
InChI
InChI=1S/C39H69NO14/c1-14-27-39(10,47)34(44)21(5)30(42)19(3)18-38(9,46)35(54-37-33(52-28(41)15-2)25(40(11)12)16-20(4)49-37)22(6)32(23(7)36(45)51-27)53-29-17-26(48-13)31(43)24(8)50-29/h19-27,29,31-35,37,43-44,46-47H,14-18H2,1-13H3/t19-,20?,21+,22+,23-,24?,
InChIKey
LDPQBQHLRNRTEU-DTJCIDMFSA-N
Synonyms

((2~(S))4(dimethylamino)2(((3~(S)4~(R)5~(R)6~(S)7~(S)9~(S)11~(S)12~(S)13~(R)14~(S))14ethyl71213trihydroxy4((2~(R)5~(S))5hydroxy4methoxy6methyloxan2yl)oxy35791113hexamethyl210dioxooxacyclotetradec6yl)oxy)6methyloxan3yl)propanoate
16405536
CCC(=O)OC1(C@@H)(OC(CC1N(C)C)C)O(C@H)1(C@H)(C)(C@@H)(O(C@H)2CC(OC)(C@H)(C(O2)C)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=1SC39H69NO14c1142739(1047)34(44)21(5)30(42)19(3)1838(946)35(543733(5228(41)152)25(40(11)12)1620(4)4937)22(6)32(23(7)36(45)5127)53291726(4813)31(43)24(8)5029h19272931353743444647H1418H2113H3t1920?21+22+2324?25?26?27293132+33?3435373839m0s1
ZINC000085911529
ZINC000253387640

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Available files

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