input word = C00040313

Metabolite InformationStructural formula
Name Sinulaflexiolide I
(-)-Sinulaflexiolide I
Formula C20H34O3
Mw 322.25079495
CAS RN 1040402-30-9
C_ID C00040313 ,
InChIKey DFJSWEJPLPHMFZ-KHAVQUBTNA-N
InChICode InChI=1S/C20H34O3/c1-15-7-6-8-16(2)10-12-18(21)20(5,23)14-13-17(11-9-15)19(3,4)22/h8-9,11,18,21-23H,6-7,10,12-14H2,1-5H3/b15-9+,16-8+,17-11+/t18-,20+/m0/s1
SMILES C/C1=CC=C(C(C)(C)O)CC[C@@](C)(O)[C@@H](O)CC/C(C)=C/CC1
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
--Sinularia flexibilis Ref.
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