| Name |
Craigoside A |
| Formula |
C61H86O34 |
| Mw |
1362.5000499 |
| CAS RN |
879561-99-6 |
| C_ID |
C00034829
, 
|
| InChIKey |
UJBGOJBICNWSIL-FEKCEXACNA-N |
| InChICode |
InChI=1S/C61H86O34/c1-8-26-29(33(53(78)81-5)21-86-56(26)93-59-50(75)47(72)44(69)37(16-63)90-59)12-40(66)84-19-25(15-62)43-32(20-85-41(67)13-30-27(9-2)57(87-22-34(30)54(79)82-6)94-60-51(76)48(73)45(70)38(17-64)91-60)24(4)11-36(43)89-42(68)14-31-28(10-3)58(88-23-35(31)55(80)83-7)95-61-52(77)49(74)46(71)39(18-65)92-61/h8-10,21-25,29-32,36-39,43-52,56-65,69-77H,11-20H2,1-7H3/b26-8+,27-9+,28-10+/t24-,25-,29-,30+,31-,32+,36-,37+,38+,39+,43-,44+,45+,46+,47-,48-,49-,50+,51+,52+,56-,57-,58-,59-,60-,61-/m0/s1 |
| SMILES |
C/C=C1C(CC(=O)OC[C@H]2[C@H]([C@@H](CO)COC(=O)C[C@@H]3C(C(=O)OC)=CO[C@@H](O[C@@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4O)/C3=C/C)[C@@H](OC(=O)C[C@@H]3C(C(=O)OC)=COC(O[C@@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4O)/C3=C/C)C[C@@H]2C)C(C(=O)OC)=CO[C@H]1O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O |
| Start Substs in Alk. Biosynthesis (Prediction) |
|
| Organism |
| Kingdom |
Family |
Species |
Reference |
| Plantae | Oleaceae | Jasminum abyssinicum | Ref. |
|
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