input word = C00048124

Metabolite InformationStructural formula
Name Sipholenone D
(-)-Sipholenone D
Formula C30H50O4
Mw 474.37091008
CAS RN 329050-20-6
C_ID C00048124 ,
InChIKey VMQJMMQIBHGNCM-ZZOLKSCBNA-N
InChICode InChI=1S/C30H50O4/c1-19-9-10-22-21(13-17-29(22,7)32)26(2,3)20(19)11-12-23-28(6)16-14-24(31)27(4,5)34-25(28)15-18-30(23,8)33/h11,19,21-23,25,32-33H,9-10,12-18H2,1-8H3/b20-11-/t19-,21+,22+,23+,25+,28+,29+,30-/m0/s1
SMILES C([C@@H]1[C@@]2([C@@H](CC[C@]1(C)O)OC(C(=O)CC2)(C)C)C)/C=C/1\C([C@H]2[C@@H](CC[C@@H]1C)[C@](CC2)(C)O)(C)C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
--Callyspongia siphonella Ref.
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OrganismCallyspongia siphonella
ReferenceJain,J.Nat.Prod.,72,(2009),1291