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(Q105308210)
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Theraphin C
chemical compound
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Statements
instance of
type of chemical entity
0 references
subclass of
4-(1-Hydroxypropyl)-5,7-dihydroxy-6-(3-methyl-2-butenyl)-8-(3-methylbutyryl)-2H-1-benzopyran-2-one
1 reference
based on heuristic
inferred from SMILES
mass
388.188588616
dalton
1 reference
based on heuristic
inferred from SMILES
stereoisomer of
5,7-dihydroxy-4-[(1R)-1-hydroxypropyl]-8-(3-methylbutanoyl)-6-(3-methylbut-2-enyl)chromen-2-one
1 reference
based on heuristic
inferred from InChI
chemical formula
C₂₂H₂₈O₆
0 references
canonical SMILES
O=C1OC=2C(=C(O)C(=C(O)C2C(=C1)C(O)CC)CC=C(C)C)C(=O)CC(C)C
0 references
isomeric SMILES
CC[C@H](O)c1cc(=O)oc2c(C(=O)CC(C)C)c(O)c(CC=C(C)C)c(O)c12
0 references
found in taxon
Mesua assamica
1 reference
stated in
Biologically active alkylated coumarins from Kayea assamica
Identifiers
InChI
InChI=1S/C22H28O6/c1-6-15(23)14-10-17(25)28-22-18(14)20(26)13(8-7-11(2)3)21(27)19(22)16(24)9-12(4)5/h7,10,12,15,23,26-27H,6,8-9H2,1-5H3/t15-/m0/s1
0 references
InChIKey
WLTRJQPEAXRLHQ-HNNXBMFYSA-N
0 references
PubChem CID
9977572
2 references
stated in
PubChem
retrieved
17 September 2022
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
WLTRJQPEAXRLHQ-HNNXBMFYSA-N
UniChem compound ID
32700896
1 reference
stated in
UniChem
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