Name |
Capsianoside IX |
Formula |
C44H74O21 |
Mw |
938.47225943 |
CAS RN |
914306-82-4 |
C_ID |
C00054362
|
InChIKey |
OEXNWSIXBSIJSR-XOZHZZGWSA-N |
InChICode |
InChI=1S/C44H74O21/c1-7-44(6,65-43-37(56)33(52)30(49)26(18-46)62-43)16-10-15-25(17-45)14-9-12-21(2)11-8-13-22(3)19-58-41-38(57)34(53)39(64-42-36(55)32(51)29(48)24(5)61-42)27(63-41)20-59-40-35(54)31(50)28(47)23(4)60-40/h7,12-13,15,23-24,26-43,45-57H,1,8-11,14,16-20H2,2-6H3/b21-12+,22-13-,25-15-/t23-,24-,26+,27+,28-,29-,30+,31+,32+,33-,34+,35+,36+,37+,38+,39+,40+,41+,42-,43-,44+/m0/s1 |
SMILES |
O[C@H]1[C@H](O)[C@@H](O)[C@H](O[C@@](C=C)(C)CC/C=C(CO)/CC/C=C(C)/CC/C=C(CO[C@@H]2O[C@H](CO[C@H]3[C@H](O)[C@H](O)[C@@H](O)[C@H](C)O3)[C@@H](O[C@H]4[C@H](O)[C@H](O)[C@@H](O)[C@H](C)O4)[C@H](O)[C@H]2O)/C)O[C@@H]1CO |
Start Substs in Alk. Biosynthesis (Prediction) |
|
Organism |
Kingdom |
Family |
Species |
Reference |
Plantae | Solanaceae | Capsicum annuum | Ref. |
|
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zoom in
Organism | Capsicum annuum | Reference | De Marino, S. et al., J. Agric. Food Chem., 2006, 54, 7508-7516 (Capsianoside IX) |
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