input word = C00051495

Metabolite InformationStructural formula
Name Massonianoside A
Formula C25H32O10
Mw 492.19954724
CAS RN 623945-11-9
C_ID C00051495
InChIKey DKOVFEOUMNYYQW-BCLHWYQJNA-N
InChICode InChI=1S/C25H32O10/c1-12-20(29)21(30)22(31)25(34-12)33-11-16-15-8-13(4-3-7-26)9-18(28)24(15)35-23(16)14-5-6-17(27)19(10-14)32-2/h5-6,8-10,12,16,20-23,25-31H,3-4,7,11H2,1-2H3/t12-,16-,20-,21+,22+,23+,25+/m0/s1
SMILES COc1cc(C2Oc3c(O)cc(CCCO)cc3[C@@H]2CO[C@@H]2O[C@@H](C)[C@H](O)[C@@H](O)[C@H]2O)ccc1O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeCupressaceaeChamaecyparis formosensis Ref.
PlantaePinaceaePinus massoniana Ref.
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OrganismChamaecyparis formosensis
ReferenceChang, M-L. et al., Molecules, 23, (2018), 604