input word = C00038255

Metabolite InformationStructural formula
Name 3-Epiocotillol
3-epi-Ocotillol
Formula C30H52O3
Mw 460.39164553
CAS RN 35761-53-6
C_ID C00038255 ,
InChIKey RQBNSDSKUAGBOI-OGWQAWBHNA-N
InChICode InChI=1S/C30H52O3/c1-25(2)21-12-17-29(7)22(27(21,5)15-13-23(25)31)10-9-19-20(11-16-28(19,29)6)30(8)18-14-24(33-30)26(3,4)32/h19-24,31-32H,9-18H2,1-8H3/t19-,20+,21+,22-,23-,24-,27+,28-,29-,30+/m1/s1
SMILES C1[C@H](C([C@H]2[C@](C1)([C@@H]1[C@@](CC2)([C@]2([C@H](CC1)[C@H](CC2)[C@]1(O[C@H](CC1)C(C)(C)O)C)C)C)C)(C)C)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeMeliaceaeAglaia foveolata Ref.
PlantaeMeliaceaeAglaia tomentosa Ref.
--Cabralea polytricha Ref.
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