| Name |
Pelargoniin D |
| Formula |
C27H24O19 |
| Mw |
652.09117859 |
| CAS RN |
302777-20-4 |
| C_ID |
C00037607
, 
|
| InChIKey |
YLWUMIWVHGNITI-XBIMBKSENA-N |
| InChICode |
InChI=1S/C27H24O19/c28-5-13-16(17-8(25(41)43-13)3-12(32)19(36)21(17)38)9(4-15(33)34)26(42)45-23-22(39)20(37)14(6-29)44-27(23)46-24(40)7-1-10(30)18(35)11(31)2-7/h1-3,5,9,14,20,22-23,27,29-32,35-39H,4,6H2,(H,33,34)/t9-,14+,20+,22-,23+,27-/m0/s1 |
| SMILES |
c1(oc(=O)c2c(c1[C@@H](C(=O)O[C@@H]1[C@H]([C@@H]([C@H](O[C@H]1OC(=O)c1cc(c(c(c1)O)O)O)CO)O)O)CC(=O)O)c(c(c(c2)O)O)O)C=O |
| Start Substs in Alk. Biosynthesis (Prediction) |
|
| Organism |
| Kingdom |
Family |
Species |
Reference |
| Plantae | Geraniaceae | Pelargonium reniforme | Ref. |
|
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