input word = C00036722

Metabolite InformationStructural formula
Name Ananosic acid A
(-)-Ananosic acid A
Formula C30H46O3
Mw 454.34469533
CAS RN 402942-25-0
C_ID C00036722 ,
InChIKey KNYVORLBUHFUJF-RJWQZTJBNA-N
InChICode InChI=1S/C30H46O3/c1-18(9-8-10-19(2)27(32)33)21-13-15-30(7)22-11-12-24-28(4,5)25(31)14-16-29(24,6)23(22)17-20(3)26(21)30/h10-11,18,20,23-25,31H,8-9,12-17H2,1-7H3,(H,32,33)/b19-10-/t18-,20-,23+,24+,25-,29-,30-/m1/s1
SMILES C/C(=C/CC[C@@H](C)C1=C2[C@H](C)C[C@H]3C(=CC[C@H]4C(C)(C)[C@H](O)CC[C@]34C)[C@]2(C)CC1)C(=O)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeSchisandraceaeKadsura ananosma Ref.
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OrganismKadsura ananosma
ReferenceChen,Phytochem.,58,(2001),1277