input word = C00021289

Metabolite InformationStructural formula
Name Patchoulan-1,12-diol
Formula C15H26O2
Mw 238.19328007
CAS RN
C_ID C00021289 ,
InChIKey RTSORXBIZDRAMP-DEUOFTKMNA-N
InChICode InChI=1S/C15H26O2/c1-13(2)11-5-6-14(3)12(8-11)10(9-16)4-7-15(13,14)17/h10-12,16-17H,4-9H2,1-3H3/t10-,11-,12+,14+,15+/m1/s1
SMILES C1[C@@H]([C@@H]2C[C@H]3CC[C@@]2([C@](C1)(C3(C)C)O)C)CO
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeLabiataePogostemon cablin Ref.
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