input word = C00029451

Metabolite InformationStructural formula
Name 2alpha-Hydroxyursolic acid
Corsolic acid
Glucosol
Corosolic acid
Formula C30H48O4
Mw 472.35526002
CAS RN 4547-24-4
C_ID C00029451 ,
InChIKey HFGSQOYIOKBQOW-FEBUVDNLNA-N
InChICode InChI=1S/C30H48O4/c1-17-10-13-30(25(33)34)15-14-28(6)19(23(30)18(17)2)8-9-22-27(5)16-20(31)24(32)26(3,4)21(27)11-12-29(22,28)7/h8,17-18,20-24,31-32H,9-16H2,1-7H3,(H,33,34)/t17-,18+,20-,21+,22-,23+,24+,27+,28-,29-,30+/m1/s1
SMILES [C@@H]1([C@@H](C([C@H]2[C@](C1)([C@@H]1[C@@](CC2)([C@]2(C(=CC1)[C@H]1[C@@](CC2)(CC[C@H]([C@@H]1C)C)C(=O)O)C)C)C)(C)C)O)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeLabiataeDracocephalum kotschyi Ref.
PlantaeLabiataePerilla frutescens (L.) Britton var.japonica Hara Ref.
PlantaeLabiataeSalvia trijuga Ref.
PlantaeMelastomataceaeMonochaetum vulcanicum Ref.
PlantaeMyrtaceaeEucalyptus tereticornis Ref.
PlantaeMyrtaceaeMelaleuca leucadendron Ref.
PlantaeMyrtaceaePsidium guajava Ref.
PlantaeOleaceaeOlea europaea Ref.
PlantaeRosaceaeChaenomeles sinensis KOEHNE Ref.
PlantaeRosaceaePrunus serrulate var. spontanea Ref.
PlantaeRosaceaeRubus alceaefolius Ref.
PlantaeTheaceae/Pentaphylacaceae/TernstroemiaceaeTernstroemia gymnanthera Ref.
--Chamaenerion angustifolium Ref.
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