input word = C00030938

Metabolite InformationStructural formula
Name Pelorol
Formula C23H32O4
Mw 372.23005951
CAS RN 287974-44-1
C_ID C00030938 ,
InChIKey FFBLMLRQAKGTJN-UOMJGSFBNA-N
InChICode InChI=1S/C23H32O4/c1-21(2)8-6-9-22(3)16(21)7-10-23(4)17(22)12-13-18(23)14(20(26)27-5)11-15(24)19(13)25/h11,16-17,24-25H,6-10,12H2,1-5H3/t16-,17+,22-,23+/m0/s1
SMILES c1c(c(c2c(c1C(=O)OC)[C@]1([C@H](C2)[C@@]2([C@@H](CC1)C(CCC2)(C)C)C)C)O)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
--Dactylospongia elegans Ref.
--Hippospongia sp. Ref.
--Petrosaspongia metachromia Ref.
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