input word = C00014548

Metabolite InformationStructural formula
Name Crinatusin B1
Formula C27H32O4
Mw 420.23005951
CAS RN 321392-53-4
C_ID C00014548 ,
InChIKey DJCRMQTYRMUEBG-MMYMAHBINA-N
InChICode InChI=1S/C27H32O4/c1-17(2)9-8-10-19-13-14-21(22(15-19)20-11-6-5-7-12-20)27(30)25-24(31-4)16-23(28)18(3)26(25)29/h5-7,9,11-13,16,21-22,28-29H,8,10,14-15H2,1-4H3/t21-,22+/m1/s1
SMILES C1C(=CC[C@H]([C@@H]1c1ccccc1)C(=O)c1c(c(c(cc1OC)O)C)O)CCC=C(C)C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAnnonaceaeCyathocalyx crinatus Ref.
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