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Everolimus Retroaldol Degradation Product, TRC
Tekniske data
Tekniske data
| Kemisk navn eller materiale | Everolimus Retroaldol Degradation Product |
| CAS | 1708118-13-1 |
| Molekylær formel | C53H83NO14 |
| Mængde | 10 mg |
| Synonym | (S)-(2R,3S,6R,E)-1-((1S,3R,4R)-4-(2-Hydroxyethoxy)-3-methoxycyclohexyl)-2,6,8-trimethyl-5,9-dioxonon-7-en-3-yl 1-(2-((2R,3R,6S)-6-((2S,3E,5E,7E,9S,11R)-2,13-dimethoxy-3,9,11-trimethyl-12-oxotrideca-3,5,7-trien-1-yl)-2-hydroxy-3-methyltetrahydro-2H-pyran-2-yl)-2-oxoacetyl)piperidine-2-carboxylate, Everolimus Ring-opening Impurity |
| InChI formel | InChI=1S/C53H83NO14/c1-34(26-38(5)45(58)33-63-8)16-12-11-13-17-36(3)47(64-9)30-42-21-19-40(7)53(62,68-42)50(59)51(60)54-23-15-14-18-43(54)52(61)67-48(31-44(57)37(4)27-35(2)32-56)39(6)28-41-20-22-46(66-25-24-55)49(29-41)65-10/h11-13,16-17,27,32,34,37-43,46-49,55,62H,14-15,18-26,28-31,33H2,1-10H3/b13-11+,16-12+,35-27+,36-17+/t34-,37-,38-,39-,40-,41+,42+,43+,46-,47+,48+,49-,53-/m1/s1 |
| SMIL | C[C@H](C[C@@]1([H])C[C@@H](OC)[C@H](OCCO)CC1)[C@]([H])(CC([C@H](C)/C=C(C=O)\C)=O)OC([C@H]2N(C(C([C@@]3(O)[C@H](C)CC[C@@]([H])(C[C@H](OC)/C(C)=C/C=C/C=C/[C@@H](C)C[C@@H](C)C(COC)=O)O3)=O)=O)CCCC2)=O |
| IUPAC navn | [(E,2R,3S,6R)-1-[(1S,3R,4R)-4-(2-hydroxyethoxy)-3-methoxycyclohexyl]-2,6,8-trimethyl-5,9-dioxonon-7-en-3-yl] (2S)-1-[2-[(2R,3R,6S)-6-[(2S,3E,5E,7E,9S,11R)-2,13-dimethoxy-3,9,11-trimethyl-12-oxotrideca-3,5,7-trienyl]-2-hydroxy-3-methyloxan-2-yl]-2-oxoacetyl]piperidine-2-carboxylate |
| Molekylvægt (g/mol) | 958.22 |
| Formel vægt | 957.5814 |
Produkttitel
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