input word = C00023211

Metabolite InformationStructural formula
Name [2S-[2alpha,3alpha,4abeta,5beta(S*),8aalpha]]-1,2,3,4,4a,5,8,8a-Octahydro-5-(3-hydroxy-3-methyl-4-pentenyl)-1,1,4a,6-tetramethyl-2,3-naphthalenediol
Formula C20H34O3
Mw 322.25079495
CAS RN 125205-96-1
C_ID C00023211 ,
InChIKey SEEULDQMEPIFEB-BRDBHVLONA-N
InChICode InChI=1S/C20H34O3/c1-7-19(5,23)11-10-14-13(2)8-9-16-18(3,4)17(22)15(21)12-20(14,16)6/h7-8,14-17,21-23H,1,9-12H2,2-6H3/t14-,15+,16-,17+,19-,20-/m0/s1
SMILES [C@@H]1([C@H](C([C@H]2[C@@](C1)([C@H](C(=CC2)C)CC[C@](C)(C=C)O)C)(C)C)O)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAsteraceaeWaitzia acuminata Ref.
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