| Name |
Robustanic acid
3beta-Hydroxy-11alpha-methoxyurs-12-en-28-oic acid |
| Formula |
C31H50O4 |
| Mw |
486.37091008 |
| CAS RN |
422308-58-5 |
| C_ID |
C00045045
, 
|
| InChIKey |
INDFCQCOCFVHHY-SRWOPRSRNA-N |
| InChICode |
InChI=1S/C31H50O4/c1-18-9-14-31(26(33)34)16-15-29(6)20(24(31)19(18)2)17-21(35-8)25-28(5)12-11-23(32)27(3,4)22(28)10-13-30(25,29)7/h17-19,21-25,32H,9-16H2,1-8H3,(H,33,34)/t18-,19+,21+,22+,23+,24+,25-,28+,29-,30-,31+/m1/s1 |
| SMILES |
CO[C@@H]1C=C2[C@@H]3[C@@H](C)[C@H](C)CC[C@]3(C(=O)O)CC[C@@]2(C)[C@]2(C)CC[C@H]3C(C)(C)[C@@H](O)CC[C@]3(C)[C@@H]12 |
| Start Substs in Alk. Biosynthesis (Prediction) |
|
| Organism |
| Kingdom |
Family |
Species |
Reference |
| Plantae | Theaceae/Pentaphylacaceae/Ternstroemiaceae | Ternstroemia gymnanthera | Ref. |
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