input word = C00047758

Metabolite InformationStructural formula
Name Bisglaucumlide I
Formula C41H60O9
Mw 696.42373351
CAS RN 1146218-64-5
C_ID C00047758 ,
InChIKey VYPXVZODBQHVDG-VWSUBIDBNA-N
InChICode InChI=1S/C41H60O9/c1-23(2)29-20-33(43)26(5)12-10-11-24(3)17-28(42)22-41(38(46)49-9)31-18-25(4)13-14-35-39(7,47)16-15-36(50-35)40(8,48)34(44)21-30(31)27(6)19-32(41)37(29)45/h12,17-18,23,29,31-32,34-36,44,47-48H,10-11,13-16,19-22H2,1-9H3/b24-17-,25-18+,26-12+/t29-,31-,32+,34-,35-,36+,39+,40-,41+/m0/s1
SMILES COC(=O)[C@]12CC(=O)/C=C(/C)CC/C=C(C)C(=O)C[C@@H](C(C)C)C(=O)[C@H]1CC(C)=C1C[C@H](O)[C@](C)(O)[C@H]3CC[C@@](C)(O)C(CC/C(C)=C/[C@@H]12)O3
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeOrchidaceaeSarcophyton glaucum Ref.
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