input word = C00048533

Metabolite InformationStructural formula
Name Serjanic acid
Formula C31H48O5
Mw 500.35017464
CAS RN 25488-57-7
C_ID C00048533 ,
InChIKey BZXSGMYHHGCPEN-QSRRXREMNA-N
InChICode InChI=1S/C31H48O5/c1-26(2)21-10-13-30(6)22(28(21,4)12-11-23(26)32)9-8-19-20-18-27(3,25(35)36-7)14-16-31(20,24(33)34)17-15-29(19,30)5/h8,20-23,32H,9-18H2,1-7H3,(H,33,34)/t20-,21-,22+,23-,27-,28-,29+,30+,31-/m0/s1
SMILES C1[C@@H]2[C@](CC[C@]1(C)C(=O)OC)(CC[C@@]1(C2=CC[C@H]2[C@]1(CC[C@@H]1[C@@]2(CC[C@@H](C1(C)C)O)C)C)C)C(=O)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAsteraceaeBrasilia serjana Ref.
PlantaePutranjivaceaeDrypetes inaequalis Ref.
zoom in