A189840
Acidihydroergocristine
| Trivial name | Acidihydroergocristine |
| Catalog Number | TRC-A189840-25MG |
| Alternative Name(s) | (2'β,5'α,10α)-9,10-Dihydro-12'-hydroxy-2'-(1-methylethyl)-5'-(phenylmethyl)ergotaman-3',6',18-trione; 9,10-Dihydro-2'-epiergocristine; Acidihydroergocristine; aci-Dihydroergocristine |
| Molecular Formula | C₃₅H₄₁N₅O₅ |
| CAS# | 76189-70-3 |
| Inchi | InChI=1S/C35H41N5O5/c1-20(2)34(37-31(41)23-16-25-24-11-7-12-26-30(24)22(18-36-26)17-27(25)38(3)19-23)33(43)40-28(15-21-9-5-4-6-10-21)32(42)39-14-8-13-29(39)35(40,44)45-34/h4-7,9-12,18,20,23,25,27-29,36,44H,8,13-17,19H2,1-3H3,(H,37,41)/t23-,25-,27-,28+,29+,34+,35+/m1/s1 |
| SMILES | [H][C@]12[C@@](N(C)C[C@H](C(N[C@]3(C(C)C)C(N([C@@H](CC4=CC=CC=C4)C(N5[C@@]6([H])CCC5)=O)[C@@]6(O)O3)=O)=O)C2)([H])CC7=CNC8=C7C1=CC=C8 |
| Beilstein Registry Number | NA |
| Size | 25mg |
| Supplier Page | https://www.lgcstandards.com/CA/en/p/TRC-A189840-25MG |