input word = C00022088

Metabolite InformationStructural formula
Name 3,13-Di-O-beta-D-glucopyranosilgeranyllinalol
Formula C32H54O12
Mw 630.36152719
CAS RN 104109-52-6
C_ID C00022088 ,
InChIKey NKGPACRFWDREDH-MZYZNSKDNA-N
InChICode InChI=1S/C32H54O12/c1-7-32(6,44-31-29(40)27(38)25(36)23(17-34)43-31)13-9-12-19(4)10-8-11-20(5)15-21(14-18(2)3)41-30-28(39)26(37)24(35)22(16-33)42-30/h7,11-12,14,21-31,33-40H,1,8-10,13,15-17H2,2-6H3/b19-12+,20-11+/t21-,22+,23-,24+,25+,26-,27-,28-,29-,30+,31-,32+/m0/s1
SMILES [C@](CC/C=C(/CC/C=C(/C[C@H](C=C(C)C)O[C@H]1[C@H]([C@H]([C@@H]([C@H](O1)CO)O)O)O)\C)\C)(C=C)(C)O[C@H]1[C@H]([C@H]([C@@H]([C@@H](O1)CO)O)O)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeDryopteridaceaeArachniodes maximowiczii Ref.
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OrganismArachniodes maximowiczii
ReferenceTanaka,Chem. Pharm. Bull.,34,(1986),1015