input word = C00003455

Metabolite InformationStructural formula
Name Montanin
Formula C32H48O8
Mw 560.33491851
CAS RN 66583-55-9
C_ID C00003455 ,
InChIKey SNFRINMTRPQQLE-NIASKTQONA-N
InChICode InChI=1S/C32H48O8/c1-6-7-8-9-10-11-12-13-14-15-30-38-25-23-26-29(18-33,37-26)27(35)31(36)22(16-20(4)24(31)34)32(23,40-30)21(5)17-28(25,39-30)19(2)3/h16,21-23,25-27,33,35-36H,2,6-15,17-18H2,1,3-5H3/t21-,22-,23-,25-,26+,27-,28-,29+,30+,31-,32+/m1/s1
SMILES [C@@H]12[C@]([C@@H]([C@@]3([C@H]([C@@H]4[C@@]51[C@@H](C[C@]1([C@@H]4O[C@@](O1)(O5)CCCCCCCCCCC)C(=C)C)C)O3)CO)O)(C(=O)C(=C2)C)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeEuphorbiaceaeBaliospermum montanum Ref.
PlantaeEuphorbiaceaeNeoboutonia glabrescens Prain Ref.
zoom in