input word = C00054967

Metabolite InformationStructural formula
Name Dammadienol
Formula C30H50O
Mw 426.38616622
CAS RN 20460-34-8
C_ID C00054967
InChIKey FHVRTHIWQBTFQE-CDEXHJJRSA-N
InChICode InChI=1S/C30H50O/c1-20(2)10-9-11-21(3)22-14-18-29(7)23(22)12-13-25-28(6)17-16-26(31)27(4,5)24(28)15-19-30(25,29)8/h10-11,22-26,31H,9,12-19H2,1-8H3/b21-11+/t22-,23-,24+,25-,26+,28+,29-,30-/m1/s1
SMILES C[C@@]12[C@](CC[C@]3(C)[C@]2([H])CC[C@@]4([H])[C@@]3(C)CC[C@@H]4/C(C)=C/C/C=C(C)/C)([H])C(C)(C)[C@@H](O)CC1
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAsteraceaeInula helenium Ref.
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