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(Q105105113)
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English
artesunate
group of stereoisomers
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Statements
instance of
group of stereoisomers
0 references
subclass of
1,4-dimethyl-2-butyl-3-isopropylcyclohexane sesquiterpenoid
1 reference
inferred from
1,4-dimethyl-2-butyl-3-isopropylcyclohexane sesquiterpenoid
mass
384.17841785599995
dalton
1 reference
based on heuristic
inferred from isomeric SMILES
chemical formula
C₁₉H₂₈O₈
0 references
canonical SMILES
O=C(O)CCC(=O)OC1OC2OC3(OOC24C(CC3)C(C)CCC4C1C)C
0 references
isomeric SMILES
C[C@@H]1CC[C@H]2[C@@H](C)[C@@H](OC(=O)CCC(=O)O)O[C@@H]3OC4(C)CC[C@@H]1[C@@]23OO4
0 references
Identifiers
InChI
InChI=1S/C19H28O8/c1-10-4-5-13-11(2)16(23-15(22)7-6-14(20)21)24-17-19(13)12(10)8-9-18(3,25-17)26-27-19/h10-13,16-17H,4-9H2,1-3H3,(H,20,21)/t10-,11-,12+,13+,16+,17-,18?,19-/m1/s1
0 references
InChIKey
FIHJKUPKCHIPAT-JQXDXKTESA-N
0 references
PubChem CID
5464098
2 references
stated in
PubChem
retrieved
26 December 2021
inferred from
InChIKey
matched by identifier from
InChIKey
InChIKey
FIHJKUPKCHIPAT-JQXDXKTESA-N
UniChem compound ID
24276689
1 reference
stated in
UniChem
Probes And Drugs ID
PD078723
0 references
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