input word = C00024969

Metabolite InformationStructural formula
Name Spiramacetal
Formula C22H30O5
Mw 374.20932407
CAS RN 212968-29-1
C_ID C00024969 ,
InChIKey BCVUSHCDLNESII-LOVGMDFDNA-N
InChICode InChI=1S/C22H30O5/c1-11-10-21-8-5-13(11)9-14(21)22-7-4-6-20(3)16(22)15(25-12(2)23)17(21)26-19(22)27-18(20)24/h10,13-19,24H,4-9H2,1-3H3/t13-,14+,15-,16+,17+,18+,19-,20-,21?,22+/m0/s1
SMILES [C@@H]1([C@]2(CCC[C@]34[C@H](O1)O[C@H]([C@H]([C@H]23)OC(=O)C)[C@]12CC[C@@H](C[C@@H]41)C(=C2)C)C)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeRosaceaeSpiraea japonica var.acuta Ref.
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