input word = C00040169

Metabolite InformationStructural formula
Name Rohituka-14
Formula C31H38O10
Mw 570.24649744
CAS RN 246854-46-6
C_ID C00040169 ,
InChIKey ULYJPGZRBXBUMU-LUFUSIGVNA-N
InChICode InChI=1S/C31H38O10/c1-15(2)9-23(34)40-27-26-25(16(3)31(36)20(32)10-18(30(27,31)6)17-7-8-37-13-17)29(5)19-11-22(33)38-14-28(19,4)41-24(35)12-21(29)39-26/h7-8,13,15,18-19,21,25-27,36H,3,9-12,14H2,1-2,4-6H3/t18-,19-,21-,25+,26+,27-,28+,29+,30+,31+/m0/s1
SMILES [C@@]12([C@H](CC(=O)O[C@]3([C@@H]1CC(=O)OC3)C)O[C@@H]1[C@H]2C(=C)[C@@]2([C@@]([C@H]1OC(=O)CC(C)C)([C@@H](CC2=O)c1cocc1)C)O)C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeMeliaceaeAphanamixis polystacha Ref.
zoom in