input word = C00050010

Metabolite InformationStructural formula
Name Balsaminone B
Formula C27H22O10
Mw 506.12129692
CAS RN 213271-56-8
C_ID C00050010 ,
InChIKey NAVQPSCNRHEZLY-MTWXFFPSNA-N
InChICode InChI=1S/C27H22O10/c1-34-26-17-16-18(29)11-6-2-3-7-12(11)19(30)25(16)36-23(17)13-8-4-5-9-14(13)24(26)37-27-22(33)21(32)20(31)15(10-28)35-27/h2-9,15,20-22,27-28,31-33H,10H2,1H3/t15-,20-,21+,22-,27+/m1/s1
SMILES COc1c(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)c2ccccc2c2oc3c(c12)C(=O)c1ccccc1C3=O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeBalsaminaceaeImpatiens balsamina Ref.
zoom in