input word = C00029486

Metabolite InformationStructural formula
Name 3alpha-Hydroxyolean-12-en-27-oic acid
Formula C30H48O3
Mw 456.3603454
CAS RN 64652-15-9
C_ID C00029486 ,
InChIKey QGOSJBZFTWGWDU-DNFRYEDMNA-N
InChICode InChI=1S/C30H48O3/c1-25(2)14-15-27(5)16-17-30(24(32)33)19(20(27)18-25)8-9-22-28(6)12-11-23(31)26(3,4)21(28)10-13-29(22,30)7/h8,20-23,31H,9-18H2,1-7H3,(H,32,33)/t20-,21-,22+,23+,27+,28-,29+,30+/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)C(=O)O)C)C)(C)C)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeSaxifragaceaeAceriphyllum rossii Ref.
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