input word = C00007276

Metabolite InformationStructural formula
Name 5alpha-ergostanol
5-alpha-Campestanol
Formula C28H50O
Mw 402.38616622
CAS RN 6538-02-9
C_ID C00007276 ,
InChIKey ARYTXMNEANMLMU-IXRAGGLKNA-N
InChICode InChI=1S/C28H50O/c1-18(2)19(3)7-8-20(4)24-11-12-25-23-10-9-21-17-22(29)13-15-27(21,5)26(23)14-16-28(24,25)6/h18-26,29H,7-17H2,1-6H3/t19-,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](CC[C@@H](C(C)C)C)C)C)C)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeApocynaceaeCatharanthus roseus Ref.
PlantaeAsteraceaeCalendula officinalis Ref.
PlantaeCruciferaeArabidopsis thaliana Ref.
PlantaePosidoniaceaePosidonia oceanica Ref.
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OrganismCatharanthus roseus
ReferenceNakajima,Phytochem.,60,(2002),275