| Name |
19-dehydroursolic acid
19-Dehydroursolic acid |
| Formula |
C30H46O3 |
| Mw |
454.34469533 |
| CAS RN |
6812-98-2 |
| C_ID |
C00052565
|
| InChIKey |
HKJOHXSLBNLQHF-OXLNSTONSA-N |
| InChICode |
InChI=1S/C30H46O3/c1-18-10-15-30(25(32)33)17-16-28(6)20(24(30)19(18)2)8-9-22-27(5)13-12-23(31)26(3,4)21(27)11-14-29(22,28)7/h8,21-24,31H,9-17H2,1-7H3,(H,32,33)/t21-,22+,23-,24-,27-,28+,29+,30-/m0/s1 |
| SMILES |
CC1=C(C)CC[C@]2(C(O)=O)CC[C@@]3(C)[C@]4(C)CC[C@@]5([H])C(C)(C)[C@@H](O)CC[C@]5(C)[C@@]4([H])CC=C3[C@@]21[H] |
| Start Substs in Alk. Biosynthesis (Prediction) |
|
| Organism |
| Kingdom |
Family |
Species |
Reference |
| Plantae | Aquifoliaceae | Ilex asprella | Ref. |
| Plantae | Aquifoliaceae | Ilex pubescens  | Ref. |
| Plantae | Rosaceae | Sanguisorba officinalis | Ref. |
|
|
zoom in
| Organism | Sanguisorba officinalis |
|---|
| Reference | Barton, D.H.R. et al., JCS, 1962, 5163-5175 (Vanguieria tomentosa constits) |
|---|
|
