input word = C00051499

Metabolite InformationStructural formula
Name Massonianoside E
Formula C25H32O10
Mw 492.19954724
CAS RN 872037-79-1
C_ID C00051499
InChIKey HPDPYAHMPOJDTI-NMPIWZEBNA-N
InChICode InChI=1S/C25H32O10/c1-13-21(28)22(29)23(30)25(33-13)32-9-3-4-14-5-8-17-19(10-14)34-20(12-26)24(35-17)15-6-7-16(27)18(11-15)31-2/h5-8,10-11,13,20-30H,3-4,9,12H2,1-2H3/t13-,20?,21-,22+,23+,24?,25+/m0/s1
SMILES COc1cc(C2Oc3ccc(CCCO[C@@H]4O[C@@H](C)[C@H](O)[C@@H](O)[C@H]4O)cc3OC2CO)ccc1O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaePinaceaePinus massoniana Ref.
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