input word = C00012693

Metabolite InformationStructural formula
Name Heterophyllol
(4alpha,4aalpha,7alpha)-(+)-4,4a,5,6,7,8-hexahydro-4-hydroxy-7-[1-(hydroxymethyl)ethenyl]-1,4a-dimethyl-2(3H)-naphthalenone
Formula C15H22O3
Mw 250.15689457
CAS RN 73537-23-2
C_ID C00012693 ,
InChIKey VPNGFQLHLSUGNT-SWLHIULTNA-N
InChICode InChI=1S/C15H22O3/c1-9(8-16)11-4-5-15(3)12(6-11)10(2)13(17)7-14(15)18/h11,14,16,18H,1,4-8H2,2-3H3/t11-,14-,15-/m1/s1
SMILES C1(=C2[C@]([C@@H](CC1=O)O)(CC[C@H](C2)C(=C)CO)C)C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeApocynaceaeParsonsia heterophylla Ref.
--Parsonia heterophylla Ref.
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