input word = C00003611

Metabolite InformationStructural formula
Name Cerbertin
Formula C32H46O10
Mw 590.30909769
CAS RN 7227-00-1
C_ID C00003611 ,
InChIKey IFNWZFVEJHHHIZ-CHHWZACVNA-N
InChICode InChI=1S/C32H46O10/c1-15-24(35)26(37-5)27(40-16(2)33)29(39-15)41-19-8-10-30(3)18(13-19)6-7-21-23(30)25-28(42-25)31(4)20(9-11-32(21,31)36)17-12-22(34)38-14-17/h12,15,18-21,23-29,35-36H,6-11,13-14H2,1-5H3/t15-,18-,19+,20-,21-,23-,24+,25+,26+,27-,28+,29-,30-,31+,32+/m1/s1
SMILES COC1C(OC(C)=O)[C@H](O[C@H]2CCC3(C)[C@H](CC[C@@H]4[C@@H]3[C@@H]3O[C@@H]3[C@]3(C)[C@@H](C5=CC(=O)OC5)CC[C@]43O)C2)OC(C)[C@@H]1O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeApocynaceaeCerbera dilatata Ref.
PlantaeApocynaceaeCerbera floribunda Ref.
--Cerberta dilatata Ref.
--Cerberta floribunda Ref.
zoom in



OrganismCerbera floribunda
ReferenceHarborne,Phytochemical Dictionary Second Edition,Taylor and Francis,(1999),Chapter55