input word = C00049585

Metabolite InformationStructural formula
Name Sarcotol acetate
Formula C22H36O4
Mw 364.26135964
CAS RN 161897-63-8
C_ID C00049585 ,
InChIKey BHSGVCGSYDQSIG-DVSZTTNCNA-N
InChICode InChI=1S/C22H36O4/c1-16(2)19-9-12-21(5,15-26-18(4)23)20(24)14-17(3)8-7-11-22(6,25)13-10-19/h8,10,13,16,19,25H,7,9,11-12,14-15H2,1-6H3/b13-10+,17-8+/t19-,21-,22-/m1/s1
SMILES CC(=O)OC[C@@]1(C)CC[C@@H](C(C)C)/C=C/[C@](C)(O)CC/C=C(C)CC1=O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
--Oryzia latipes Ref.
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