input word = C00057619

Metabolite InformationStructural formula
Name Orizaterpenoid
Formula C28H44O3
Mw 428.32904527
CAS RN 873685-23-5
C_ID C00057619
InChIKey XRPNJEUKGXCPEX-OZHWRMQCSA-N
InChICode InChI=1S/C28H44O3/c1-7-8-9-11-19(2)12-10-13-20(3)14-15-22-21(4)23-18-24-27(22,5)17-16-25(29)28(24,6)26(30)31-23/h9,11,18-23H,7-8,10,12-17H2,1-6H3/b11-9+/t19-,20-,21-,22+,23+,27-,28+/m1/s1
SMILES CCC/C=C/[C@@H](C)CCC[C@@H](C)CC[C@H]1[C@@H](C)[C@@H]2C=C3[C@@](C)(C(=O)CC[C@@]31C)C(=O)O2
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaePoaceaeOryza sativa Ref.
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OrganismOryza sativa
ReferenceChung, I.M. et al., Chem. Nat. Compd. (Engl. Transl.), 2005, 41, 182-189