input word = C00024972

Metabolite InformationStructural formula
Name Spiramilactone
Formula C20H28O4
Mw 332.19875938
CAS RN 176177-60-9
C_ID C00024972 ,
InChIKey RBBBGTLGABWVIR-GNXOIZGCNA-N
InChICode InChI=1S/C20H28O4/c1-11-12-4-7-20(16(11)22)14(8-12)19-6-3-5-18(2,10-24-17(19)23)13(19)9-15(20)21/h12-16,21-22H,1,3-10H2,2H3/t12-,13+,14-,15+,16-,18-,19-,20+/m0/s1
SMILES C1[C@]2([C@@H]3[C@](C(=O)O1)([C@H]1[C@]4([C@@H](C3)O)[C@H](C(=C)[C@H](C1)CC4)O)CCC2)C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeRosaceaeSpiraea japonica var.incisa Ref.
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