input word = C00033565

Metabolite InformationStructural formula
Name 3-Acetyl oleanolic acid
3-O-Acetyloleanolic acid
(+)-3-O-Acetyloleanolic acid
3beta-Acetoxyolean-12-en-28-oic acid
Acetyloleanolic acid
(+)-Acetyloleanolic acid
Oleanolic acid acetate
(+)-Oleanolic acid acetate
Formula C32H50O4
Mw 498.37091008
CAS RN 4339-72-4
C_ID C00033565 ,
InChIKey RIXNFYQZWDGQAE-WKUXLVQTNA-N
InChICode InChI=1S/C32H50O4/c1-20(33)36-25-12-13-29(6)23(28(25,4)5)11-14-31(8)24(29)10-9-21-22-19-27(2,3)15-17-32(22,26(34)35)18-16-30(21,31)7/h9,22-25H,10-19H2,1-8H3,(H,34,35)/t22-,23-,24+,25-,29-,30+,31+,32-/m0/s1
SMILES C1[C@@H](C([C@H]2[C@](C1)([C@@H]1[C@@](CC2)([C@]2(C(=CC1)[C@H]1[C@@](CC2)(CCC(C1)(C)C)C(=O)O)C)C)C)(C)C)OC(=O)C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAsteraceaeHelichrysum forskahlii Ref.
PlantaeAsteraceaeSenecio burtonii Ref.
PlantaeBetulaceaeBetula platyphylla Ref.
PlantaeCelastraceaeTripterygium hypoglaucum Ref.
PlantaeDipterocarpaceaeDryobalanops aromatica Ref.
PlantaeEbenaceaeDiospyros eriantha Ref.
PlantaeEbenaceaeDiospyros lotus Ref.
PlantaeEuphorbiaceaeCleidion spiciflorum (Burm. f.) Merr. Ref.
PlantaeFabaceaeDalbergia barretoana Ref.
PlantaeFabaceaeDalbergia odorifera Ref.
PlantaeFabaceaeEysenhardtia platycarpa Ref.
PlantaeLabiataeSalvia amplexicaulis Lam. Ref.
PlantaeLabiataeSalvia staminea Ref.
PlantaeLabiataeSideritis kuegleriana Ref.
PlantaeLardizabalaceaeAkebia lagerocemora Ref.
PlantaeLardizabalaceaeAkebia quinata Ref.
PlantaeLardizabalaceaeAkebia trifoliata Ref.
PlantaeLardizabalaceaeStauntonia obovatifoliola Hayata subsp.intermedia Ref.
PlantaeLauraceaeLitsea elliptica Ref.
PlantaeOleaceaeLigustrum lucidum Ref.
PlantaePhytolaccaceaePhytolacca americana Ref.
PlantaePutranjivaceaeDrypetes molunduana Pax and Hoffm Ref.
PlantaeRanunculaceaePulsatilla chinensis Ref.
PlantaeRubiaceaeRubia cordifolia L. Ref.
PlantaeStilbaceaeNuxia sphaerocephala Ref.
PlantaeVerbenaceaeLippia sidoides Ref.
--Millintonia hortensis Ref.
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