| Name |
Xuxuasin A |
| Formula |
C56H72O6 |
| Mw |
840.53289003 |
| CAS RN |
815582-49-1 |
| C_ID |
C00032528
, 
|
| InChIKey |
CCZAEQUGYKPALJ-AAFKBUJZNA-N |
| InChICode |
InChI=1S/C56H72O6/c1-29-23-41-49(5,27-38(29)58)17-20-55(11)48-47-46(43-32(4)44(60)37(57)26-36(43)51(48,7)19-21-53(41,55)9)62-45-31(3)33-13-15-52(8)35(34(33)25-40(45)61-47)14-16-54(10)42-24-30(2)39(59)28-50(42,6)18-22-56(52,54)12/h13-15,25-26,29-30,41-42,46-48,57,60H,16-24,27-28H2,1-12H3/t29-,30-,41-,42-,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[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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