input word = C00048723

Metabolite InformationStructural formula
Name Griffinisterone D
(-)-Griffinisterone D
Formula C28H42O3
Mw 426.31339521
CAS RN 1024589-29-4
C_ID C00048723 ,
InChIKey BJALYGAREJSWPE-MKQYLSMJNA-N
InChICode InChI=1S/C28H42O3/c1-17(2)18(3)6-8-22(26(30)31)24-11-10-23-21-9-7-19-16-20(29)12-14-27(19,4)25(21)13-15-28(23,24)5/h12,14,17,19,21-25H,3,6-11,13,15-16H2,1-2,4-5H3,(H,30,31)/t19-,21-,22+,23-,24+,25-,27-,28+/m0/s1
SMILES C1[C@H]2[C@H]([C@H]3[C@@](C1)([C@H](CC3)[C@@H](CCC(=C)C(C)C)C(=O)O)C)CC[C@@H]1[C@@]2(C=CC(=O)C1)C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
--Dendronephthya griffini Ref.
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OrganismDendronephthya griffini
ReferenceBlunt,Nat.Prod.Rep.,27,(2010),165