Name |
Congmunoside XIV |
Formula |
C57H92O23 |
Mw |
1144.60293925 |
CAS RN |
329969-14-4 |
C_ID |
C00054784
|
InChIKey |
ITUZCAGKIFGPEA-HRHXFEMOSA-N |
InChICode |
InChI=1S/C57H92O23/c1-9-10-21-72-46(70)44-42(69)43(77-48-40(67)37(64)35(62)29(23-58)74-48)45(79-47-39(66)34(61)28(60)25-73-47)50(78-44)76-33-14-15-54(6)31(53(33,4)5)13-16-56(8)32(54)12-11-26-27-22-52(2,3)17-19-57(27,20-18-55(26,56)7)51(71)80-49-41(68)38(65)36(63)30(24-59)75-49/h11,27-45,47-50,58-69H,9-10,12-25H2,1-8H3/t27-,28+,29+,30+,31-,32+,33-,34-,35-,36+,37-,38-,39+,40+,41+,42-,43-,44-,45+,47-,48-,49-,50+,54-,55+,56+,57-/m0/s1 |
SMILES |
C[C@@]12CC[C@@]3([H])C(C)(C)[C@@H](O[C@@H]4O[C@H](C(OCCCC)=O)[C@@H](O)[C@H](O[C@@H]5O[C@H](CO)[C@H](O)[C@H](O)[C@H]5O)[C@H]4O[C@@H]6OC[C@@H](O)[C@H](O)[C@H]6O)CC[C@]3(C)[C@@]1([H])CC=C7[C@]8([H])CC(C)(C)CC[C@]8(C(O[C@H]9[C@H](O)[C@@H](O)[C@H](O)[C@@H](CO)O9)=O)CC[C@]72C |
Start Substs in Alk. Biosynthesis (Prediction) |
|
Organism |
Kingdom |
Family |
Species |
Reference |
Plantae | Araliaceae | Aralia elata | Ref. |
|
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Organism | Aralia elata | Reference | Kochetkov, N.K. et al., Izv. Akad. Nauk SSSR, Ser. Khim., 1963, 1398 (Aralosides) |
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