input word = C00025000

Metabolite InformationStructural formula
Name Spiraminol
Formula C20H28O4
Mw 332.19875938
CAS RN 137782-06-0
C_ID C00025000 ,
InChIKey JPFRZBFWRTXIGT-ACLWNYGWNA-N
InChICode InChI=1S/C20H28O4/c1-10-11-4-7-20(15(10)21)13(8-11)19-6-3-5-18(2)12(19)9-14(20)23-17(19)24-16(18)22/h11-17,21-22H,1,3-9H2,2H3/t11-,12+,13-,14+,15-,16-,17-,18+,19-,20+/m0/s1
SMILES [C@H]12O[C@@H]3C[C@@H]4[C@]([C@H](O1)O)(CCC[C@]24[C@H]1[C@]23[C@H](C(=C)[C@H](C1)CC2)O)C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeRosaceaeSpiraea japonica var.acuminata Ref.
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