Analyte Name

20-Deoxo-23-deoxy-5-O-[3,6-dideoxy-3-(dimethylamino)-beta-D-glucopyranosyl]-23-iodo-20-(1-piperidinyl)tylonolide

CAS Number

1003024-02-9

Molecular Formula

C36 H61 I N2 O8

Molecular Weight

776.783

Accurate Mass

776.347

SMILES

CC[C@H]1OC(=O)C[C@@H](O)[C@H](C)[C@@H](O[C@@H]2O[C@H](C)[C@@H](O)[C@@H](C2O)N(C)C)[C@@H](CCN3CCCCC3)C[C@@H](C)C(=O)\C=C\C(=C\[C@@H]1CI)\C

InChI

InChI=1S/C36H61IN2O8/c1-8-30-27(21-37)18-22(2)12-13-28(40)23(3)19-26(14-17-39-15-10-9-11-16-39)35(24(4)29(41)20-31(42)46-30)47-36-34(44)32(38(6)7)33(43)25(5)45-36/h12-13,18,23-27,29-30,32-36,41,43-44H,8-11,14-17,19-21H2,1-7H3/b13-12+,22-18+/t23-,24+,25-,26+,27-,29-,30-,32+,33-,34?,35-,36+/m1/s1

IUPAC

(4R,5S,6S,7R,9R,11E,13E,15S,16R)-6-[(2R,4S,5S,6R)-4-(dimethylamino)-3,5-dihydroxy-6-methyloxan-2-yl]oxy-16-ethyl-4-hydroxy-15-(iodomethyl)-5,9,13-trimethyl-7-(2-piperidin-1-ylethyl)-1-oxacyclohexadeca-11,13-diene-2,10-dione

Shipping Temperature

Room Temperature

Country of Origin

CANADA

Product Format

Neat