input word = C00048698

Metabolite InformationStructural formula
Name Durumolide E
(+)-Durumolide E
Formula C20H26O5
Mw 346.17802394
CAS RN 1065642-13-8
C_ID C00048698 ,
InChIKey PDNDDMYQUGCRSU-YGAGGYKVNA-N
InChICode InChI=1S/C20H26O5/c1-12-6-4-8-13(2)17(22)18-15(14(3)19(23)24-18)10-16-20(11-21,25-16)9-5-7-12/h7-8,11,15-18,22H,3-6,9-10H2,1-2H3/b12-7-,13-8+/t15-,16-,17-,18-,20+/m1/s1
SMILES C\1=C(\CC/C=C(/[C@H]([C@H]2[C@H](C[C@@H]3[C@@](CC1)(O3)C=O)C(=C)C(=O)O2)O)\C)/C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
--Lobophytum durum Ref.
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