input word = C00010641

Metabolite InformationStructural formula
Name trans-1,2,trans-1,5-2-(1-Formylethyl)-5-methyl-cyclopentanecarboxylic acidNepetalic acid
Formula C10H16O3
Mw 184.10994438
CAS RN 21651-54-7
C_ID C00010641 ,
InChIKey RGTMAXSVLBZNEL-BWNVTPFRNA-N
InChICode InChI=1S/C10H16O3/c1-6-3-4-8(7(2)5-11)9(6)10(12)13/h5-9H,3-4H2,1-2H3,(H,12,13)/t6-,7+,8-,9+/m1/s1
SMILES C1C[C@@H]([C@H]([C@@H]1C)C(=O)O)[C@H](C=O)C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeLabiataeNepeta cataria Ref.
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