input word = C00035252

Metabolite InformationStructural formula
Name Bauerenol
Baurenol
Formula C30H50O
Mw 426.38616622
CAS RN 6466-94-0
C_ID C00035252 ,
InChIKey TZVDWGXUGGUMCE-BBNAWYAZNA-N
InChICode InChI=1S/C30H50O/c1-19-11-14-27(5)17-18-29(7)22-9-10-23-26(3,4)24(31)13-15-28(23,6)21(22)12-16-30(29,8)25(27)20(19)2/h9,19-21,23-25,31H,10-18H2,1-8H3/t19-,20+,21+,23+,24+,25-,27-,28-,29-,30+/m1/s1
SMILES C1[C@@H](C([C@H]2[C@](C1)([C@@H]1C(=CC2)[C@@]2([C@@](CC1)([C@H]1[C@@](CC2)(CC[C@H]([C@@H]1C)C)C)C)C)C)(C)C)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAsteraceaeArtemisia annua Ref.
PlantaeBoraginaceaeEhretia microphylla Lamk.(Carmosa retusa(Vahl.)Masam.) Ref.
PlantaeCruciferaeArabidopsis thaliana Ref.
PlantaeEbenaceaeDiospyros ebenum Ref.
PlantaeEbenaceaeDiospyros kirkii Ref.
PlantaeEbenaceaeDiospyros melanoxylon Ref.
PlantaeEbenaceaeDiospyros mespiliformis Ref.
PlantaeEbenaceaeDiospyros sylvatica Ref.
PlantaeMalvaceaeAdansonia digitata Ref.
PlantaeMoraceaeFicus carica Ref.
PlantaeMyrsinaceaeArdisia japonica Ref.
PlantaeMyrsinaceaeArdisia solanacea Ref.
PlantaeRubiaceaePsychotria adenophylla Ref.
PlantaeRutaceaeAcronychia baueri Schott. Ref.
PlantaeSolanaceaeSolanum lycopersicum Ref.
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