| Name |
Asparagus officinalis Anthocyanin A1 |
| Formula |
C33H41O20+ |
| Mw |
757.21911875 |
| CAS RN |
1037068-20-4 |
| C_ID |
C00054529
|
| InChIKey |
LSIHLVAATDSBMQ-LRIWEGBYSA-O |
| InChICode |
InChI=1S/C33H40O20/c1-10-21(39)24(42)26(44)31(48-10)47-9-20-23(41)30(53-32-27(45)25(43)22(40)19(8-34)51-32)28(46)33(52-20)50-18-7-13-15(37)5-12(35)6-17(13)49-29(18)11-2-3-14(36)16(38)4-11/h2-7,10,19-28,30-34,39-46H,8-9H2,1H3,(H3-,35,36,37,38)/p+1/t10-,19+,20+,21-,22+,23+,24+,25-,26+,27+,28+,30-,31+,32-,33+/m0/s1 |
| SMILES |
C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](Oc3cc4c(O)cc(O)cc4[o+]c3-c3ccc(O)c(O)c3)[C@H](O)[C@@H](O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)[C@@H]2O)[C@H](O)[C@H](O)[C@H]1O |
| Start Substs in Alk. Biosynthesis (Prediction) |
|
| Organism |
| Kingdom |
Family |
Species |
Reference |
| Plantae | Asparagaceae | Asparagus officinalis  | Ref. |
|
|
zoom in
| Organism | Asparagus officinalis |
|---|
| Reference | Grove, K.E. et al., JCS, 1934, 1608-1611 (Mecocyanin) |
|---|
|
