input word = C00060301

Metabolite InformationStructural formula
Name (2R-cis)-4-[2,3-Dihydro-7-hydroxy-3-(hydroxymethyl)-5-(3-hydroxypropyl)-2-benzofuranyl]-2-methoxyphenyl 6-deoxy-alpha-L-mannopyranoside
Formula C25H32O10
Mw 492.19954724
CAS RN 167819-20-7
C_ID C00060301
InChIKey PHHIEOZUONPPQY-QDCFJCCASA-N
InChICode InChI=1S/C25H32O10/c1-12-20(29)21(30)22(31)25(33-12)34-18-6-5-14(10-19(18)32-2)23-16(11-27)15-8-13(4-3-7-26)9-17(28)24(15)35-23/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)cc3C2CO)ccc1OC1OC(C)C(O)C(O)C1O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaePinaceaePicea abies Ref.
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OrganismPicea abies
Referencehttps://doi.org/10.1016/0031-9422(95)00144-V