input word = C00063463

Metabolite InformationStructural formula
Name Lanicepside A
Formula C26H34O12
Mw 538.20502655
CAS RN 944746-27-4
C_ID C00063463
InChIKey LDDSFQCOUIDFIZ-FQBKCVSJSA-N
InChICode InChI=1S/C26H34O12/c1-34-18-8-13(3-5-16(18)29)25-14(9-27)15(11-36-25)21(30)12-4-6-17(19(7-12)35-2)37-26-24(33)23(32)22(31)20(10-28)38-26/h3-8,14-15,20-33H,9-11H2,1-2H3/t14?,15?,20-,21?,22-,23+,24-,25?,26-/m1/s1
SMILES COc1cc(C2OCC(C(O)c3ccc(OC4OC(CO)C(O)C(O)C4O)c(OC)c3)C2CO)ccc1O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeValerianaceae/Linnaeaceae/Dipsacaceae/DiervillaceaeValeriana officinalis Ref.
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