| Name |
Camellidin I |
| Formula |
C55H86O25 |
| Mw |
1146.5458183 |
| CAS RN |
96827-22-4 |
| C_ID |
C00003507
, 
|
| InChIKey |
TVDLDADJOJWXBX-WEZBSLPANA-N |
| InChICode |
InChI=1S/C55H86O25/c1-22(59)80-55-21-50(2,3)14-11-23(55)24(60)17-54(8)30(55)10-9-29-52(6)15-13-31(51(4,5)28(52)12-16-53(29,54)7)75-49-43(78-47-39(68)36(65)33(62)26(19-57)73-47)40(69)41(44(79-49)45(70)71)76-48-42(37(66)34(63)27(20-58)74-48)77-46-38(67)35(64)32(61)25(18-56)72-46/h10,23,25-29,31-44,46-49,56-58,61-69H,9,11-21H2,1-8H3,(H,70,71)/t23-,25-,26+,27+,28+,29-,31+,32-,33+,34+,35+,36+,37+,38+,39-,40+,41+,42-,43-,44+,46+,47+,48+,49+,52+,53-,54-,55+/m1/s1 |
| SMILES |
CC(=O)O[C@@]12CC(C)(C)CC[C@@H]1C(=O)C[C@]1(C)C2=CC[C@@H]2[C@@]3(C)CC[C@H](O[C@@H]4OC(C(=O)O)[C@@H](O[C@@H]5OC(CO)[C@H](O)[C@H](O)C5O[C@@H]5OC(CO)[C@@H](O)[C@H](O)C5O)[C@H](O)C4O[C@@H]4OC(CO)[C@H](O)[C@H](O)C4O)C(C)(C)[C@@H]3CC[C@]21C |
| Start Substs in Alk. Biosynthesis (Prediction) |
|
| Organism |
| Kingdom |
Family |
Species |
Reference |
| Plantae | Theaceae | Camellia japonica  | Ref. |
|
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