input word = C00029487

Metabolite InformationStructural formula
Name 3beta,6alpha-Dihydroxylup-20(29)-ene
Formula C30H50O2
Mw 442.38108084
CAS RN 279255-75-3
C_ID C00029487 ,
InChIKey DSXMIKAVZFWLFV-KSHHLKDSNA-N
InChICode InChI=1S/C30H50O2/c1-18(2)19-11-13-27(5)15-16-29(7)20(24(19)27)9-10-22-28(6)14-12-23(32)26(3,4)25(28)21(31)17-30(22,29)8/h19-25,31-32H,1,9-17H2,2-8H3/t19-,20+,21-,22+,23-,24-,25-,27+,28+,29+,30+/m0/s1
SMILES C1[C@@H](C([C@H]2[C@](C1)([C@@H]1[C@@](C[C@@H]2O)([C@]2([C@H](CC1)[C@H]1[C@](CC2)(C)CC[C@H]1C(=C)C)C)C)C)(C)C)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeApocynaceaePeriploca aphylla Ref.
PlantaePutranjivaceaeDrypetes tessmanniana Ref.
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