| Name |
Junceoside C |
| Formula |
C64H100O31 |
| Mw |
1364.62485648 |
| CAS RN |
393085-16-0 |
| C_ID |
C00046055
, 
|
| InChIKey |
KEXAKVAEOKDKBR-NCPVLKQONA-N |
| InChICode |
InChI=1S/C64H100O31/c1-24-34(69)39(74)49(93-54-44(79)40(75)46(25(2)87-54)90-52-41(76)35(70)28(67)21-84-52)56(86-24)95-58(83)64-17-15-59(3,4)19-27(64)26-9-10-32-60(5)13-12-33(61(6,23-66)31(60)11-14-63(32,8)62(26,7)16-18-64)89-57-50(94-55-43(78)38(73)37(72)30(20-65)88-55)47(45(80)48(92-57)51(81)82)91-53-42(77)36(71)29(68)22-85-53/h9,23-25,27-50,52-57,65,67-80H,10-22H2,1-8H3,(H,81,82)/t24-,25+,27+,28-,29-,30-,31-,32-,33+,34+,35+,36+,37+,38+,39+,40-,41-,42-,43-,44-,45+,46+,47+,48+,49-,50-,52+,53+,54+,55+,56+,57-,60-,61+,62-,63-,64+/m1/s1 |
| SMILES |
[C@@H]1([C@@H]([C@H]([C@@H](OC1)O[C@@H]1[C@H](O)[C@H]([C@@H](O[C@H]1C)O[C@H]1[C@@H](O[C@@H]([C@@H]([C@@H]1O)O)C)OC(=O)[C@]12[C@H](C3=CC[C@H]4[C@]([C@@]3(CC1)C)(CC[C@@H]1[C@]4(CC[C@@H]([C@]1(C=O)C)O[C@@H]1O[C@@H]([C@H]([C@@H]([C@H]1O[C@@H]1O[C@@H]([C@@H]([C@@H]([C@H]1O)O)O)CO)O[C@@H]1OC[C@H]([C@@H]([C@H]1O)O)O)O)C(=O)O)C)C)CC(CC2)(C)C)O)O)O)O |
| Start Substs in Alk. Biosynthesis (Prediction) |
|
| Organism |
| Kingdom |
Family |
Species |
Reference |
| Plantae | Caryophyllaceae | Arenaria juncea | Ref. |
|
|
zoom in
| Organism | Arenaria juncea |
|---|
| Reference | Gaidi,J.Nat.Prod.,64,(2001),1533 |
|---|
|
