input word = C00059450

Metabolite InformationStructural formula
Name (1aR,4S,4aR,7R,7aR,7bR)-Decahydro-7-(hydroxymethyl)-1,1,4-trimethyl-1H-cycloprop[e]azulene-4,7-diol
Formula C15H26O3
Mw 254.1881947
CAS RN 1224881-32-6
C_ID C00059450
InChIKey CVYITTAKSVZPNY-ACBLYQCWSA-N
InChICode InChI=1S/C15H26O3/c1-13(2)9-4-6-14(3,17)10-5-7-15(18,8-16)12(10)11(9)13/h9-12,16-18H,4-8H2,1-3H3/t9-,10-,11-,12+,14+,15+/m1/s1
SMILES CC1(O)CCC2C(C3C1CCC3(O)CO)C2(C)C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeValerianaceae/Linnaeaceae/Dipsacaceae/DiervillaceaeValeriana officinalis Ref.
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