input word = C00046719

Metabolite InformationStructural formula
Name Dictyoceratin A
Formula C23H32O4
Mw 372.23005951
CAS RN 104900-68-7
C_ID C00046719 ,
InChIKey FMHCCRKQMUIWGQ-JOQXURALNA-N
InChICode InChI=1S/C23H32O4/c1-14-7-6-8-19-22(14,3)10-9-15(2)23(19,4)13-17-11-16(21(26)27-5)12-18(24)20(17)25/h11-12,15,19,24-25H,1,6-10,13H2,2-5H3/t15-,19+,22+,23+/m0/s1
SMILES [C@@H]1(CC[C@]2([C@H]([C@@]1(Cc1cc(cc(c1O)O)C(=O)OC)C)CCCC2=C)C)C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
--Petrosaspongia metachromia Ref.
--Polyfibrospongia australis Ref.
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OrganismPolyfibrospongia australis
ReferenceShen,J.Nat.Prod.,60,(1997),93