A179128
13-Acetyl-9-dihydrobaccatin-III
| Trivial name | 13-Acetyl-9-dihydrobaccatin-III |
| Catalog Number | TRC-A179128-10MG |
| Alternative Name(s) | 7,9-dideacetylbaccatin VI; 9-Dihydro-13-acetylbaccatin III; Di-O-deacetylbaccatin VI; [2aR-(2aα,4β,4aβ,5α,6β,9α,11α,12α,12aα,12bα)]-2a,3,4,4a,5,6,9,10,12,12a-Decahydro-4a,8,13,13-tetramethyl-7,11-methano-1H-cyclodeca[3,4]benz[1,2-b]oxete-4,5,6,9,11,12,12b-heptol 6,9,12b-Triacetate 12-benzoate |
| Molecular Formula | C₃₃H₄₂O₁₂ |
| CAS# | 142203-65-4 |
| Inchi | InChI=1S/C33H42O12/c1-16-21(42-17(2)34)14-33(40)28(44-29(39)20-11-9-8-10-12-20)26-31(7,22(37)13-23-32(26,15-41-23)45-19(4)36)27(38)25(43-18(3)35)24(16)30(33,5)6/h8-12,21-23,25-28,37-38,40H,13-15H2,1-7H3/t21-,22-,23+,25+,26-,27-,28-,31+,32-,33+/m0/s1 |
| SMILES | CC1(C)[C@@]([C@H]2OC(C3=CC=CC=C3)=O)(O)C[C@H](OC(C)=O)C(C)=C1[C@@H](OC(C)=O)[C@H](O)[C@@]4(C)[C@@]2([H])[C@@](CO5)(OC(C)=O)[C@@]5([H])C[C@@H]4O |
| Beilstein Registry Number | NA |
| Size | 10mg |
| Supplier Page | https://www.lgcstandards.com/CA/en/p/TRC-A179128-10MG |