input word = C00033551

Metabolite InformationStructural formula
Name 2beta,3beta-Dihydroxy-5alpha-pregn-17(Z)-en-16-one
Formula C21H32O3
Mw 332.23514489
CAS RN 194033-63-1
C_ID C00033551 ,
InChIKey SNBODTQYFCSFKC-VTHQVCQGNA-N
InChICode InChI=1S/C21H32O3/c1-4-14-17(22)10-16-13-6-5-12-9-18(23)19(24)11-21(12,3)15(13)7-8-20(14,16)2/h4,12-13,15-16,18-19,23-24H,5-11H2,1-3H3/b14-4+/t12-,13+,15-,16-,18+,19-,20+,21-/m0/s1
SMILES [C@H]1([C@@H](C[C@H]2[C@](C1)([C@@H]1[C@@H](CC2)[C@H]2[C@](CC1)(/C(=C/C)/C(=O)C2)C)C)O)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeMeliaceaeAglaia forbesii Ref.
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OrganismAglaia forbesii
ReferenceJoycharat,Phytochem.,69,(2008),206