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Artemisin

PropertiesImage
MNX_IDMNXM42703 Image of MNXM42703
referencechebi:2852
formulaC15H18O4
global charge0
mol weight262.305
InChIKeyLUHMMHZLDLBAKX-DBIGVJDZSA-N
InChIInChI=1S/C15H18O4/c1-7-9(16)4-5-15(3)6-10(17)11-8(2)14(18)19-13(11)12(7)15/h4-5,8,10-11,13,17H,6H2,1-3H3/t8-,10-,11+,13-,15+/m0/s1
SMILESCC1=C2[C@H]3OC(=O)[C@@H](C)[C@@H]3[C@@H](O)C[C@@]2(C)C=CC1=O
MNX internals
InChI (mnx)InChI=1/C15H18O4/c1-7-9(16)4-5-15(3)6-10(17)11-8(2)14(18)19-13(11)12(7)15/h4-5,8,10-11,13,17H,6H2,1-3H3/t8-,10-,11+,13-,15+/m0/s1 Image of MNXM42703
SMILES (mnx)[CH3:1][C:7]1=[C:12]2[C@@H:13]3[C@H:11]([C@H:8]([CH3:2])[C:14](=[O:18])[O:19]3)[C@@H:10]([OH:17])[CH2:6][C@@:15]2([CH3:3])[CH:5]=[CH:4][C:9]1=[O:16]
Parent-child relations graph
Occurences in reactions#reac
in my sandbox 0
in MNXref (generic)0
in models (compartimentalized) 0
Similar chemical compounds in external resources
IdentifierDescription

seed.compound:cpd06239
seedM:cpd06239
CHEBI:2852
chebi:2852
kegg.compound:C09344
keggC:C09344
LUHMMHZLDLBAKX-DBIGVJDZSA-N 		Artemisin
hmdb:HMDB0248621
LUHMMHZLDLBAKX-UHFFFAOYSA-N 		Artemisin
4-hydroxy-3,5a,9-trimethyl-2H,3H,3aH,4H,5H,5aH,8H,9bH-naphtho[1,2-b]furan-2,8-dione
artemisin

keggC:M_C09344
seedM:M_cpd06239 		secondary/obsolete/fantasy identifier