| Name |
Julibroside J31 |
| Formula |
C92H148O48 |
| Mw |
2020.91400659 |
| CAS RN |
884490-01-1 |
| C_ID |
C00064601
|
| InChIKey |
DXEIWTJRTBJALX-BOHDCBFSSA-N |
| InChICode |
InChI=1S/C92H148O48/c1-13-88(9,140-81-68(118)58(108)50(100)33(2)124-81)20-14-15-36(26-93)75(120)132-49-25-92(85(121)139-84-74(62(112)55(105)42(29-96)130-84)138-80-69(119)71(135-78-66(116)59(109)53(103)40(27-94)127-78)70(35(4)126-80)134-77-65(115)56(106)43(30-97)129-77)38(23-86(49,5)6)37-16-17-46-89(10)21-19-48(87(7,8)45(89)18-22-90(46,11)91(37,12)24-47(92)99)133-83-73(137-79-67(117)60(110)54(104)41(28-95)128-79)63(113)57(107)44(131-83)32-123-82-72(61(111)51(101)34(3)125-82)136-76-64(114)52(102)39(98)31-122-76/h13,15-16,33-35,38-74,76-84,93-119H,1,14,17-32H2,2-12H3/b36-15+/t33-,34-,35+,38+,39-,40-,41-,42-,43+,44-,45+,46-,47-,48+,49+,50-,51+,52+,53-,54-,55-,56+,57-,58+,59+,60+,61+,62+,63+,64-,65-,66-,67-,68-,69-,70+,71+,72-,73-,74-,76+,77+,78+,79+,80+,81+,82-,83+,84+,88-,89+,90-,91-,92-/m1/s1 |
| SMILES |
C=CC(C)(CCC=C(CO)C(=O)OC1CC2(C(=O)OC3OC(CO)C(O)C(O)C3OC3OC(C)C(OC4OC(CO)C(O)C4O)C(OC4OC(CO)C(O)C(O)C4O)C3O)C(O)CC3(C)C(=CCC4C5(C)CCC(OC6OC(COC7OC(C)C(O)C(O)C7OC7OCC(O)C(O)C7O)C(O)C(O)C6OC6OC(CO)C(O)C(O)C6O)C(C)(C)C5CCC43C)C2CC1(C)C)OC1OC(C)C(O)C(O)C1O |
| Start Substs in Alk. Biosynthesis (Prediction) |
|
| Organism |
| Kingdom |
Family |
Species |
Reference |
| Plantae | Fabaceae | Albizia julibrissin  | Ref. |
|
|
zoom in
| Organism | Albizia julibrissin |
|---|
| Reference | Singh, B and Sharma, R. A., Secondary Metabolites of Medicinal Plants, Vol. 1, (2020), Wiley-VCH Verlag GmbH and Co. KGaA. |
|---|
|
