input word = C00030451

Metabolite InformationStructural formula
Name Halosterol A
Formula C29H48O2
Mw 428.36543078
CAS RN 905973-83-3
C_ID C00030451 ,
InChIKey LXRLKMAYPPIRJM-BPEUKEAKNA-N
InChICode InChI=1S/C29H48O2/c1-7-20(18(2)3)16-27(31)19(4)24-10-11-25-23-9-8-21-17-22(30)12-14-28(21,5)26(23)13-15-29(24,25)6/h17-20,23-27,31H,7-16H2,1-6H3/t19-,20+,23-,24+,25-,26-,27+,28-,29-/m0/s1
SMILES CC[C@H](C[C@@H](O)[C@@H](C)[C@H]1CC[C@H]2[C@@H]3CCC4=CC(=O)CC[C@]4(C)[C@H]3CC[C@]12C)C(C)C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeChenopodiaceaeHaloxylon recurvum Ref.
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