| Name |
Harpuloside
(-)-Harpuloside |
| Formula |
C57H88O22 |
| Mw |
1124.5767245 |
| CAS RN |
212953-56-5 |
| C_ID |
C00044193
, 
|
| InChIKey |
FENBWPTVGNHNNX-CKYNAGITNA-N |
| InChICode |
InChI=1S/C57H88O22/c1-12-25(3)47(70)78-44-45(79-48(71)26(4)13-2)57(24-59)29(20-52(44,6)7)28-14-15-32-53(8)18-17-34(54(9,23-58)31(53)16-19-55(32,10)56(28,11)21-33(57)61)74-51-43(77-49-38(65)36(63)30(60)22-72-49)41(40(67)42(76-51)46(68)69)75-50-39(66)37(64)35(62)27(5)73-50/h12-14,27,29-45,49-51,58-67H,15-24H2,1-11H3,(H,68,69)/b25-12-,26-13-/t27-,29-,30+,31+,32+,33+,34+,35-,36-,37+,38+,39+,40-,41-,42-,43+,44-,45-,49-,50-,51+,53-,54+,55+,56+,57-/m0/s1 |
| SMILES |
C/C=C(\C(=O)O[C@@H]1C(C[C@@H]2[C@]([C@H]1OC(=O)/C(=C\C)/C)([C@@H](C[C@@]1(C2=CC[C@H]2[C@]1(CC[C@@H]1[C@@]2(CC[C@H]([C@@]1(CO)C)O[C@@H]1O[C@@H]([C@H]([C@@H]([C@H]1O[C@H]1[C@H](O)[C@H]([C@@H](CO1)O)O)O[C@@H]1O[C@H]([C@@H]([C@H]([C@H]1O)O)O)C)O)C(=O)O)C)C)C)O)CO)(C)C)/C |
| Start Substs in Alk. Biosynthesis (Prediction) |
|
| Organism |
| Kingdom |
Family |
Species |
Reference |
| Plantae | Sapindaceae | Harpullia ramiflora | Ref. |
|
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