input word = C00047441

Metabolite InformationStructural formula
Name Dracotanoside D
(-)-Dracotanoside D
Formula C31H41N3O7
Mw 567.29445069
CAS RN 1165808-46-7
C_ID C00047441 ,
InChIKey CLPCQMNDVNDJJP-QCZZKYKCNA-N
InChICode InChI=1S/C31H41N3O7/c1-21-28(37)29(38)30(39)31(40-21)41-24-13-11-23(12-14-24)25-20-26(35)33-17-7-19-34(18-6-5-16-32-25)27(36)15-10-22-8-3-2-4-9-22/h2-4,8-15,21,25,28-32,37-39H,5-7,16-20H2,1H3,(H,33,35)/b15-10+/t21-,25-,28-,29+,30+,31-/m0/s1
SMILES C[C@@H]1O[C@@H](Oc2ccc([C@@H]3CC(=O)NCCCN(C(=O)/C=C/c4ccccc4)CCCCN3)cc2)[C@H](O)[C@H](O)[C@H]1O
Start Substs in Alk. Biosynthesis (Prediction) L-Trp Anthranilate L-Lys
Organism
Kingdom Family Species Reference
PlantaeLabiataeDracocephalum tanguricum Ref.
zoom in