input word = C00023808

Metabolite InformationStructural formula
Name Echinodol
Formula C32H50O4
Mw 498.37091008
CAS RN 10178-38-8
C_ID C00023808 ,
InChIKey CPTYJLQLCCZXEV-RDSURXOYNA-N
InChICode InChI=1S/C32H50O4/c1-18(2)16-23-28(35-20(4)33)19(3)27-24(36-23)17-32(9)22-10-11-25-29(5,6)26(34)13-14-30(25,7)21(22)12-15-31(27,32)8/h16,19,23-28,34H,10-15,17H2,1-9H3/t19-,23-,24+,25-,26-,27-,28+,30+,31+,32-/m0/s1
SMILES CC(=O)O[C@@H]1[C@@H](C)[C@H]2[C@@H](C[C@@]3(C)C4=C(CC[C@]23C)[C@@]2(C)CC[C@H](O)C(C)(C)[C@@H]2CC4)O[C@H]1C=C(C)C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
FungiEchinodontiaceaeEchinodontium tinctorium Ref.
FungiEchinodontiaceaeEchinodontium tsugicola Ref.
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