| Name |
Sativoside R2 |
| Formula |
C56H92O27 |
| Mw |
1196.58259774 |
| CAS RN |
126643-24-1 |
| C_ID |
C00057002
|
| InChIKey |
QERHBVOJJKVACB-UHFFFAOYSA-N |
| InChICode |
InChI=1S/C56H92O27/c1-21-7-12-56(73-19-21)22(2)34-29(83-56)14-27-25-6-5-23-13-24(8-10-54(23,3)26(25)9-11-55(27,34)4)74-50-43(70)40(67)45(33(18-60)78-50)79-53-48(47(38(65)32(17-59)77-53)81-49-41(68)35(62)28(61)20-72-49)82-52-44(71)46(37(64)31(16-58)76-52)80-51-42(69)39(66)36(63)30(15-57)75-51/h21-53,57-71H,5-20H2,1-4H3 |
| SMILES |
OCC(C(C(C1O)O)OC2C(C(C(C(O2)CO)O)OC3C(C(C(CO3)O)O)O)OC4C(C(C(C(O4)CO)O)OC5C(C(C(C(O5)CO)O)O)O)O)OC1OC6CC7CCC8C9CC%10OC%11(OCC(C)CC%11)C(C)C%10C9(C)CCC8C7(C)CC6 |
| Start Substs in Alk. Biosynthesis (Prediction) |
|
| Organism |
| Kingdom |
Family |
Species |
Reference |
| Plantae | Alliaceae | Allium sativum  | Ref. |
|
|
zoom in
| Organism | Allium sativum |
|---|
| Reference | Aldrich Library of 13C and 1H FT NMR Spectra, 1992, 3, 564A (nmr) |
|---|
|
