input word = C00045519

Metabolite InformationStructural formula
Name 16,25-Dihydroxy-13(24),17-cheilanthadien-19,25-olide
Formula C25H38O4
Mw 402.2770097
CAS RN 334491-27-9
C_ID C00045519 ,
InChIKey LWTIZOHDKCIZPP-TZEIXILXNA-N
InChICode InChI=1S/C25H38O4/c1-15-7-8-20-24(4,12-9-19-23(2,3)10-6-11-25(19,20)5)17(15)14-18(26)16-13-21(27)29-22(16)28/h13,17-20,22,26,28H,1,6-12,14H2,2-5H3/t17-,18-,19+,20-,22-,24-,25+/m1/s1
SMILES C1CC([C@H]2[C@](C1)([C@H]1[C@](CC2)([C@H](C[C@@H](O)C2=CC(=O)O[C@H]2O)C(=C)CC1)C)C)(C)C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
AnimaliaIrciniidaeIrcinia sp. Ref.
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OrganismIrcinia sp.
ReferenceBuchanan,J.Nat.Prod.,64,(2001),300