| Name |
Geraniin |
| Formula |
C41H28O27 |
| Mw |
952.0817957 |
| CAS RN |
60976-49-0 |
| C_ID |
C00002926
, 
|
| InChIKey |
JQQBXPCJFAKSPG-XEMXSNQRNA-N |
| InChICode |
InChI=1S/C41H28O27/c42-13-1-8(2-14(43)24(13)48)34(54)67-39-33-32-30(64-38(58)12-6-19(47)41(61)40(59,60)23(12)22-11(37(57)66-33)5-17(46)27(51)31(22)68-41)18(63-39)7-62-35(55)9-3-15(44)25(49)28(52)20(9)21-10(36(56)65-32)4-16(45)26(50)29(21)53/h1-6,18,23,30,32-33,39,42-46,48-53,59-61H,7H2/t18-,23?,30+,32+,33-,39-,41-/m0/s1 |
| SMILES |
Oc1cc2C(=O)OC[C@H]3[C@@H]4[C@H]([C@@H]([C@@H](O3)OC(=O)c3cc(c(c(c3)O)O)O)OC(=O)c3c5[C@@H]6C(=CC(=O)[C@](C6(O)O)(O)Oc5c(c(c3)O)O)C(=O)O4)OC(=O)c3c(c2c(c1O)O)c(c(c(c3)O)O)O |
| Start Substs in Alk. Biosynthesis (Prediction) |
|
| Organism |
| Kingdom |
Family |
Species |
Reference |
| Plantae | Cercidiphyllaceae | Cercidiphyllum spp. | Ref. |
| Plantae | Coriariaceae | Coriaria japonica  | Ref. |
| Plantae | Elaeocarpaceae | Elaeocarpus grandiflorus | Ref. |
| Plantae | Erythroxylaceae | Erythroxylum coca | Ref. |
| Plantae | Euphorbiaceae | Acalypha hispida | Ref. |
| Plantae | Euphorbiaceae | Euphorbia spp. | Ref. |
| Plantae | Euphorbiaceae | Mallotus japonicus | Ref. |
| Plantae | Geraniaceae | Geranium spp. | Ref. |
| Plantae | Nymphaeaceae | Nymphaea alba | Ref. |
| Plantae | Onagraceae | Fuchsia spp. | Ref. |
| Plantae | Sapindaceae | Acer spp. | Ref. |
| - | - | Aceraceae nikoense | Ref. |
|
|
zoom in
| Organism | Cercidiphyllum spp. |
|---|
| Reference | Harborne,Phytochemical Dictionary Second Edition,Taylor and Francis,(1999),Chapter45 |
|---|
|
