input word = C00000501

Metabolite InformationStructural formula
Name Perovskone
Formula C30H42O3
Mw 450.31339521
CAS RN 142132-39-6
C_ID C00000501 ,
InChIKey DVCBBGWACDEUAQ-NRWPDTPENA-N
InChICode InChI=1S/C30H42O3/c1-17(2)22-23(31)27-13-9-18(3)19-15-21-26(6,7)32-24(22)30(21)29(19,27)16-28(33-30)12-8-11-25(4,5)20(28)10-14-27/h9,17,19-21H,8,10-16H2,1-7H3/t19-,20-,21+,27+,28-,29-,30-/m0/s1
SMILES CC1=CC[C@]23CCC4C(C)(C)CCC[C@]45C[C@]24C1C[C@@H]1C(C)(C)OC(=C(C(C)C)C3=O)[C@@]14O5
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeLabiataePerovskia abrotanoides Ref.
PlantaeLabiataeSalvia bucharica Ref.
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OrganismSalvia bucharica
ReferenceSingh, B and Sharma, R. V., Secondary Metabolites of Medicinal Plants, Vol. 3, (2020), Wiley-VCH Verlag GmbH and Co. KGaA.