| Name |
1alpha,2alpha,3beta,30-Tetrahydroxyurs-12-ene |
| Formula |
C30H50O4 |
| Mw |
474.37091008 |
| CAS RN |
209343-87-3 |
| C_ID |
C00049070
, 
|
| InChIKey |
BKYUATYKTVXXBH-HHHOVRFCNA-N |
| InChICode |
InChI=1S/C30H50O4/c1-17-18(16-31)10-12-27(4)14-15-28(5)19(22(17)27)8-9-21-29(28,6)13-11-20-26(2,3)24(33)23(32)25(34)30(20,21)7/h8,17-18,20-25,31-34H,9-16H2,1-7H3/t17-,18-,20-,21-,22-,23-,24-,25-,27+,28+,29+,30-/m0/s1 |
| SMILES |
C[C@H]1[C@H](CO)CC[C@]2(C)CC[C@]3(C)C(=CC[C@@H]4[C@@]5(C)[C@@H](O)[C@@H](O)[C@H](O)C(C)(C)[C@@H]5CC[C@]43C)[C@H]12 |
| Start Substs in Alk. Biosynthesis (Prediction) |
|
| Organism |
| Kingdom |
Family |
Species |
Reference |
| Plantae | Gentianaceae | Gentiana neurotheca | Ref. |
|
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