input word = C00023747

Metabolite InformationStructural formula
Name 7-Dehydrocholesterol
Provitamin D3,Cholesta-5,7-dien-3beta-ol
Formula C27H44O
Mw 384.33921603
CAS RN 434-16-2
C_ID C00023747 ,
InChIKey UCTLRSWJYQTBFZ-LOPSNSAJNA-N
InChICode InChI=1S/C27H44O/c1-18(2)7-6-8-19(3)23-11-12-24-22-10-9-20-17-21(28)13-15-26(20,4)25(22)14-16-27(23,24)5/h9-10,18-19,21,23-25,28H,6-8,11-17H2,1-5H3/t19-,21+,23-,24+,25+,26+,27-/m1/s1
SMILES C1[C@@H](CC2=CC=C3[C@@H]([C@]2(C1)C)CC[C@]1([C@H]3CC[C@@H]1[C@@H](CCCC(C)C)C)C)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
FungiHypocreaceaeNectria galligena Ref.
FungiRussulaceaeLactarius sp. Ref.
FungiRussulaceaeRussula aeruginosa Ref.
FungiRussulaceaeRussula decolorans Ref.
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