input word = C00013203

Metabolite InformationStructural formula
Name Desacetylphytuberin
Phytuberol
Deacetylphytuberin
[3aR-(3aalpha,5abeta,8beta,9alphaR*)]- 5,5a,6,7,8,9-Hexahydro-alpha,alpha,3a,5a-tetramethyl-3aH-furo[3,2-c]isobenzofuran-8-methanol
Formula C15H24O3
Mw 252.17254463
CAS RN 56857-64-8
C_ID C00013203 ,
InChIKey ZOEXGOVAOFIZLY-CWQVZVRNNA-N
InChICode InChI=1S/C15H24O3/c1-12(2,16)11-5-6-13(3)10-18-14(4)7-8-17-15(13,14)9-11/h7-8,11,16H,5-6,9-10H2,1-4H3/t11-,13+,14-,15-/m1/s1
SMILES C1C[C@@]2([C@]3(C[C@@H]1C(O)(C)C)[C@](OC2)(C=CO3)C)C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeSolanaceaeNicotiana tabacum Ref.
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