input word = C00015280

Metabolite InformationStructural formula
Name 3,3',4,5'-Tetrahydroxystilbene 3'-O-beta-D-(6''-O-galloylglucopyranoside)
Piceid gallate B
Formula C27H26O13
Mw 558.13734092
CAS RN 886060-55-5
C_ID C00015280 ,
InChIKey HZCOWROLPVDVCR-INRWNPMZNA-N
InChICode InChI=1S/C27H26O13/c28-15-5-13(2-1-12-3-4-17(29)18(30)7-12)6-16(10-15)39-27-25(36)24(35)23(34)21(40-27)11-38-26(37)14-8-19(31)22(33)20(32)9-14/h1-10,21,23-25,27-36H,11H2/b2-1+/t21-,23-,24+,25-,27-/m1/s1
SMILES O=C(OCC1O[C@@H](Oc2cc(O)cc(/C=C/c3ccc(O)c(O)c3)c2)C(O)[C@@H](O)[C@@H]1O)c1cc(O)c(O)c(O)c1
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaePolygonaceaePolygonum cuspidatum Ref.
PlantaePolygonaceaePolygonum sachalinensis Ref.
PlantaePolygonaceaeRheum spp. Ref.
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