input word = C00007521

Metabolite InformationStructural formula
Name 6-Deoxoteasterone
Formula C28H50O3
Mw 434.37599546
CAS RN 188397-19-5
C_ID C00007521 ,
InChIKey WPHVOXMMNSLJSF-ODHPBZIFNA-N
InChICode InChI=1S/C28H50O3/c1-16(2)17(3)25(30)26(31)18(4)22-9-10-23-21-8-7-19-15-20(29)11-13-27(19,5)24(21)12-14-28(22,23)6/h16-26,29-31H,7-15H2,1-6H3/t17-,18-,19-,20-,21+,22+,23-,24-,25+,26+,27+,28-/m0/s1
SMILES C1[C@@H](C[C@H]2[C@@](C1)([C@@H]1[C@H](CC2)[C@H]2[C@@](CC1)([C@H](CC2)[C@H](C)[C@H]([C@@H]([C@H](C(C)C)C)O)O)C)C)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeApocynaceaeCatharanthus roseus G.Don. Ref.
PlantaeCruciferaeArabidopsis thaliana Ref.
--Paraburkholderia phymatum Ref.
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OrganismCatharanthus roseus G.Don.
ReferenceBajguz,Phytochem.,62,(2003),1027