input word = C00003715

Metabolite InformationStructural formula
Name 12alpha-Hydroxyamoorstatin
Formula C28H36O10
Mw 532.23084737
CAS RN 71590-47-1
C_ID C00003715 ,
InChIKey PUNWVWPDKCBXSA-LNXWRHAGNA-N
InChICode InChI=1S/C28H36O10/c1-12(29)37-18-9-17(31)27-11-36-23(34)24(18,2)15(27)8-16(30)26(4)21(27)20(32)22(33)25(3)14(13-5-6-35-10-13)7-19-28(25,26)38-19/h5-6,10,14-19,21-23,30-31,33-34H,7-9,11H2,1-4H3/t14-,15-,16+,17-,18+,19+,21-,22-,23+,24+,25+,26+,27+,28+/m0/s1
SMILES CC(=O)O[C@@H]1C[C@H](O)[C@@]23CO[C@@H](O)[C@]1(C)[C@@H]2C[C@@H](O)[C@]1(C)[C@@H]3C(=O)[C@H](O)[C@@]2(C)[C@H](c3ccoc3)C[C@H]3O[C@]321
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeMeliaceaeAphanamixis grandifolia Ref.
zoom in