input word = C00029665

Metabolite InformationStructural formula
Name alpha-Amyrenone
Urs-12-en-3-one
alpha-Amirenone
alpha-Amyrone
Formula C30H48O
Mw 424.37051615
CAS RN 638-96-0
C_ID C00029665 ,
InChIKey DIFWJJFSELKWGA-OHCWJNEENA-N
InChICode InChI=1S/C30H48O/c1-19-11-14-27(5)17-18-29(7)21(25(27)20(19)2)9-10-23-28(6)15-13-24(31)26(3,4)22(28)12-16-30(23,29)8/h9,19-20,22-23,25H,10-18H2,1-8H3/t19-,20+,22+,23-,25+,27-,28+,29-,30-/m1/s1
SMILES C[C@H]1[C@H](C)CC[C@]2(C)CC[C@]3(C)C(=CC[C@@H]4[C@@]5(C)CCC(=O)C(C)(C)[C@@H]5CC[C@]43C)[C@H]12
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAdoxaceaeSambucus nigra Ref.
PlantaeApocynaceaePlumeria obtusa L. Ref.
PlantaeAsteraceaeArtemisia annua Ref.
PlantaeGentianaceaeGentiana lutea Ref.
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