input word = C00015746

Metabolite InformationStructural formula
Name Bletilol A
(-)-Bletilol A
Formula C28H28O8
Mw 492.17841787
CAS RN 147235-16-3
C_ID C00015746 ,
InChIKey ICFCQLYGQGOROO-QOLAWQAJNA-N
InChICode InChI=1S/C28H28O8/c1-14(29)36-28-20(16-10-23(33-3)27(31)24(11-16)34-4)13-35-22-12-21(32-2)25-18-8-6-17(30)9-15(18)5-7-19(25)26(22)28/h6,8-12,20,28,30-31H,5,7,13H2,1-4H3/t20-,28+/m0/s1
SMILES c1c(cc2c(c1)c1c(CC2)c2c(cc1OC)OC[C@H]([C@H]2OC(=O)C)c1cc(c(c(c1)OC)O)OC)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeOrchidaceaeBletilla striata Ref.
PlantaeOrchidaceaePleione bulbocodioides Ref.
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OrganismPleione bulbocodioides
ReferenceBai,Phytochem.,47,(1998),1125