input word = C00051358

Metabolite InformationStructural formula
Name Lycernuic acid E
Formula C30H50O5
Mw 490.36582471
CAS RN 448260-75-1
C_ID C00051358
InChIKey IWZMQWDRXOQVGZ-FANLFUESNA-N
InChICode InChI=1S/C30H50O5/c1-25(2)18-10-16-30(35)17-26(3)13-9-20-28(5,15-12-23(32)29(20,6)24(33)34)19(26)7-8-21(30)27(18,4)14-11-22(25)31/h18-23,31-32,35H,7-17H2,1-6H3,(H,33,34)/t18-,19-,20+,21+,22+,23-,26-,27-,28+,29+,30-/m0/s1
SMILES CC1(C)[C@H](O)CC[C@@]2(C)[C@H]1CC[C@]1(O)C[C@]3(C)CC[C@@H]4[C@](C)(CC[C@@H](O)[C@]4(C)OC=O)[C@H]3CC[C@@H]12
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeLycopodiaceaeLycopodium cernuum Ref.
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