| Name |
Xuxuasin B |
| Formula |
C56H72O7 |
| Mw |
856.52780465 |
| CAS RN |
815582-50-4 |
| C_ID |
C00032529
, 
|
| InChIKey |
RIMKPMDQRONZDY-BPGCSVBQNA-N |
| InChICode |
InChI=1S/C56H72O7/c1-28-23-39-49(5,27-37(28)58)17-20-55(11)47-46-45(41-31(4)43(60)36(57)26-35(41)50(47,6)18-21-53(39,55)9)63-44-30(3)32-13-15-52(8)34(33(32)25-38(44)62-46)14-16-54(10)40-24-29(2)42(59)48(61)51(40,7)19-22-56(52,54)12/h13-15,25-26,28-29,39-40,45-48,57,60-61H,16-24,27H2,1-12H3/t28-,29-,39-,40-,45-,46-,47+,48-,49+,50+,51-,52-,53+,54+,55-,56-/m1/s1 |
| SMILES |
Cc1c2c(cc3c1O[C@@H]1c4c(cc(O)c(O)c4C)[C@]4(C)CC[C@@]5(C)[C@@H]6C[C@@H](C)C(=O)C[C@]6(C)CC[C@]5(C)[C@H]4[C@@H]1O3)C1=CC[C@@]3(C)[C@@H]4C[C@@H](C)C(=O)[C@@H](O)[C@]4(C)CC[C@]3(C)[C@]1(C)C=C2 |
| Start Substs in Alk. Biosynthesis (Prediction) |
|
| Organism |
| Kingdom |
Family |
Species |
Reference |
| Plantae | Celastraceae | Maytenus chuchuhuasca  | Ref. |
|
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| Organism | Maytenus chuchuhuasca | | Reference | Shirota,Chem.Pharm.Bull.,52,(2004),1148 |
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