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(Q105344609)
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English
(9-Acetyloxy-6,10-dimethyl-3-methylidene-2-oxo-3a,4,5,8,9,11a-hexahydrocyclodeca[b]furan-4-yl) 4-hydroxy-2-(hydroxymethyl)but-2-enoate
group of stereoisomers with the chemical formula C₂₂H₂₈O₈
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Statements
instance of
group of stereoisomers
0 references
subclass of
germacrane sesquiterpenoid
1 reference
inferred from
germacrane sesquiterpenoid
mass
420.178417856
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₂₂H₂₈O₈
0 references
canonical SMILES
O=C(OC1CC(=CCC(OC(=O)C)C(=CC2OC(=O)C(=C)C21)C)C)C(=CCO)CO
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found in taxon
Eupatorium cannabinum
1 reference
stated in
Sesquiterpenoids isolated from Eupatorium glehnii. Isolation of guaiaglehnin A, structure revision of Hiyodorilactone B, and genetic comparison
Eupatorium fortunei
1 reference
stated in
Sesquiterpenoids isolated from Eupatorium glehnii. Isolation of guaiaglehnin A, structure revision of Hiyodorilactone B, and genetic comparison
Eupatorium formosanum
1 reference
stated in
Sesquiterpenoids isolated from Eupatorium glehnii. Isolation of guaiaglehnin A, structure revision of Hiyodorilactone B, and genetic comparison
Isocarpha oppositifolia var. achyranthes
1 reference
stated in
Heliangolides from Isocarpha oppositifolia var. achyranthes
Identifiers
InChI
InChI=1S/C22H28O8/c1-12-5-6-17(28-15(4)25)13(2)10-19-20(14(3)21(26)29-19)18(9-12)30-22(27)16(11-24)7-8-23/h5,7,10,17-20,23-24H,3,6,8-9,11H2,1-2,4H3
0 references
InChIKey
XYPJAWWDSQFSQA-UHFFFAOYSA-N
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PubChem CID
100023
1 reference
stated in
PubChem
retrieved
17 September 2022
based on heuristic
inferred from InChIKey
UniChem compound ID
62105128
1 reference
stated in
UniChem
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