input word = C00035827

Metabolite InformationStructural formula
Name Fugaxin
Formula C30H42O10
Mw 562.27779756
CAS RN 813458-10-5
C_ID C00035827 ,
InChIKey HQVSPZGCOSJPJS-BOXLDVCVNA-N
InChICode InChI=1S/C30H42O10/c1-14-24(33)30(36-4)25(34)26(38-14)39-20-10-16-5-6-18-19(27(16,2)12-21(20)40-30)11-22(31)28(3)17(7-8-29(18,28)35)15-9-23(32)37-13-15/h9-10,14,17-22,24-26,31,33-35H,5-8,11-13H2,1-4H3/t14-,17+,18+,19-,20+,21+,22-,24+,25+,26-,27-,28-,29-,30-/m0/s1
SMILES [C@]12(O[C@H]3[C@H](O[C@@H]([C@H]1O)O[C@H]([C@H]2O)C)C=C1[C@](C3)([C@@H]2[C@@H](CC1)[C@@]1([C@]([C@H](C2)O)([C@H](CC1)C1=CC(=O)OC1)C)O)C)OC
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeHyacinthaceaeUrginea fugax (MORIS) STEINH Ref.
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OrganismUrginea fugax (MORIS) STEINH
ReferenceKrenn,Phytochem.,65,(2004),2881