input word = C00049967

Metabolite InformationStructural formula
Name 9,11-Dihydrogracilin A
Formula C23H36O5
Mw 392.25627426
CAS RN 106231-25-8
C_ID C00049967 ,
InChIKey OPYIJBCSSUHECU-IEFXETQUNA-N
InChICode InChI=1S/C23H36O5/c1-7-16-18(23(6)12-8-11-22(4,5)13-23)10-9-17-19(16)21(27-15(3)25)28-20(17)26-14(2)24/h7,17-21H,8-13H2,1-6H3/b16-7+/t17-,18+,19+,20-,21+,23+/m1/s1
SMILES [C@@H]1(CC[C@@H]2[C@H](/C/1=C/C)[C@H](O[C@H]2OC(=O)C)OC(=O)C)[C@@]1(C)CCCC(C1)(C)C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
AnimaliaDarwinellidaeDendrilla membranosa Ref.
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OrganismDendrilla membranosa
ReferenceFontana,J.Nat.Prod.,60,(1997),475