input word = C00045419

Metabolite InformationStructural formula
Name Thorectandrol D
(-)-Thorectandrol D
Formula C25H38O3
Mw 386.28209508
CAS RN 425368-62-3
C_ID C00045419 ,
InChIKey CJOXXTDBRYSHFY-VODXMDLJNA-N
InChICode InChI=1S/C25H38O3/c1-17(9-10-21(26)20-15-23(27)28-16-20)11-13-24(4)19(3)12-14-25(5)18(2)7-6-8-22(24)25/h9,15,19,21-22,26H,2,6-8,10-14,16H2,1,3-5H3/b17-9+/t19-,21+,22-,24+,25+/m0/s1
SMILES C=C1CCC[C@H]2[C@](C)(CC/C(C)=C/C[C@@H](O)C3=CC(=O)OC3)[C@@H](C)CC[C@]12C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
--Thorectandra sp. Ref.
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