| CAS Number | 1030825-28-5 |
| Catalog Number | AG008WJM(AGN-PC-0WCX2F) |
| Chemical Name | OP-1118 |
| IUPAC Name | [(2S,3R,4R,5R,6S)-6-[[(3E,5E,8S,9E,11S,12R,13E,15E,18S)-11-ethyl-8-hydroxy-18-[(1R)-1-hydroxyethyl]-9,13,15-trimethyl-2-oxo-12-[(2R,3S,4S,5S)-3,4,5-trihydroxy-6,6-dimethyloxan-2-yl]oxy-1-oxacyclooctadeca-3,5,9,13,15-pentaen-3-yl]methoxy]-4-hydroxy-5-methoxy-2-methyloxan-3-yl] 3,5-dichloro-2-ethyl-4,6-dihydroxybenzoate |
| InChI | InChI=1S/C48H68Cl2O17/c1-11-27-20-23(4)30(52)16-14-13-15-28(21-62-47-42(61-10)39(57)41(26(7)63-47)65-45(60)32-29(12-2)33(49)36(54)34(50)35(32)53)44(59)64-31(25(6)51)18-17-22(3)19-24(5)40(27)66-46-38(56)37(55)43(58)48(8,9)67-46/h13-15,17,19-20,25-27,30-31,37-43,46-47,51-58H,11-12,16,18,21H2,1-10H3/b14-13+,22-17+,23-20+,24-19+,28-15+/t25-,26+,27+,30+,31+,37-,38+,39-,40+,41+,42-,43+,46-,47+/m1/s1 |
| InChI Key | MWZWKUKATWMWGS-FXYIDGSOSA-N |
| Molecular Formula | C48H68Cl2O17 |
| Molecular Weight | 987.9493 |
| SMILES | O=C1/C(CO[C@H]2[C@@H](OC)[C@@H](O)[C@H](OC(C3=C(CC)C(Cl)=C(O)C(Cl)=C3O)=O)[C@@H](C)O2)=CC=C/C[C@H](O)/C(C)=C[C@H](CC)[C@@H](O[C@@]4([H])[C@H](O)[C@H](O)[C@@H](O)C(C)(C)O4)/C(C)=CC(C)=C/C[C@]([C@H](O)C)([H])O1 |
| UNII | J4D0XQ65KI |
| Synonyms | OP-1118,
UNII-J4D0XQ65KI,
J4D0XQ65KI,
OP-1118,
OPT-1118,
(3E,5E,8S,9E,11S,12R,13E,15E,18S)-3-(((6-Deoxy-4-O-(3,5-dichloro-2-ethyl-4,6-dihydroxybenzoyl)-2-O-methyl-beta-L-mannopyranosyl)oxy)methyl)-12-((6-deoxy-5-C-methyl-beta-D-lyxo-hexopyranosyl)oxy)-11-ethyl-8-hydroxy-18-((1R)-1-hydroxyethyl)-9,13,15-tri,
1030825-28-5,
|