input word = C00058665

Metabolite InformationStructural formula
Name Picrajavanin B
Formula C31H38O10
Mw 570.24649744
CAS RN 155969-75-8
C_ID C00058665
InChIKey QDYXUOZPVULFSE-RIFJDBKESA-N
InChICode InChI=1S/C31H38O10/c1-14-9-22(39-16(3)32)28(34)31(5)18(14)11-23-30(4)19(12-24(33)40-23)15(2)25(36-6)26(27(30)31)41-29(35)17-7-8-20-21(10-17)38-13-37-20/h7-8,10,14-15,18-19,22-23,25-27H,9,11-13H2,1-6H3/t14-,15-,18+,19+,22+,23-,25+,26-,27+,30-,31+/m1/s1
SMILES CO[C@H]1[C@H](C)[C@@H]2CC(=O)O[C@@H]3C[C@H]4[C@H](C)C[C@H](OC(C)=O)C(=O)[C@]4(C)[C@@H]([C@@H]1OC(=O)c1ccc4c(c1)OCO4)[C@@]32C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeSimaroubaceaePicrasma javanica Ref.
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