input word = C00015876

Metabolite InformationStructural formula
Name Spiranthesol
Formula C40H42O6
Mw 618.29813907
CAS RN 125263-69-6
C_ID C00015876 ,
InChIKey HXPPUWDAQKHJLL-UHFFFAOYSA-N
InChICode InChI=1S/C40H42O6/c1-21(2)7-11-28-26-13-10-24-18-35(46-6)38(40(44)37(24)29(26)15-16-33(28)41)32-20-31-27(30(39(32)43)12-8-22(3)4)14-9-23-17-25(45-5)19-34(42)36(23)31/h7-8,15-20,41-44H,9-14H2,1-6H3
SMILES c12cc(cc(c1c1c(CC2)c(c(c(c1)c1c(cc2c(c1O)c1c(CC2)c(c(cc1)O)CC=C(C)C)OC)O)CC=C(C)C)O)OC
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeOrchidaceaeSpiranthes sinensis Ref.
PlantaeOrchidaceaeSpiranthes sinensis var. amoena Ref.
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