input word = C00002245

Metabolite InformationStructural formula
Name Cyclopamine
Formula C27H41NO2
Mw 411.31372956
CAS RN 4449-51-8
C_ID C00002245 ,
InChIKey QASFUMOKHFSJGL-FWOMLRIUNA-N
InChICode InChI=1S/C27H41NO2/c1-15-11-24-25(28-14-15)17(3)27(30-24)10-8-20-21-6-5-18-12-19(29)7-9-26(18,4)23(21)13-22(20)16(27)2/h5,15,17,19-21,23-25,28-29H,6-14H2,1-4H3/t15-,17+,19-,20-,21-,23-,24+,25-,26-,27-/m0/s1
SMILES C1[C@@H](CC2=CC[C@@H]3[C@@H]([C@]2(C1)C)CC1=C([C@]2(CC[C@@H]31)O[C@H]1[C@H]([C@H]2C)NC[C@H](C1)C)C)O
Start Substs in Alk. Biosynthesis (Prediction) L-Pro L-Arg L-Asp Cholesterol
Organism
Kingdom Family Species Reference
PlantaeLiliaceaeFritillaria pallidiflora Ref.
PlantaeMelanthiaceaeVeratrum album Ref.
PlantaeMelanthiaceaeVeratrum californicum Ref.
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