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(Q104888921)
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English
(9,10,18-Trihydroxy-12,12-dimethyl-6-methylidene-7-oxo-17-oxapentacyclo[7.6.2.15,8.01,11.02,8]octadecan-15-yl) acetate
group of stereoisomers with the chemical formula C₂₂H₃₀O₇
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Statements
instance of
group of stereoisomers
0 references
subclass of
kaurane diterpenoid
1 reference
inferred from
kaurane diterpenoid
mass
406.1991533
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₂₂H₃₀O₇
0 references
canonical SMILES
O=C(OC1CCC(C)(C)C2C(O)C3(O)OCC12C4CCC5C(=C)C(=O)C43C5O)C
0 references
found in taxon
Isodon macrophyllus
1 reference
stated in
Two New Ent-kaurane Diterpenoids from Isodon Macrophyllus
Identifiers
InChI
InChI=1S/C22H30O7/c1-10-12-5-6-13-20-9-28-22(27,21(13,16(10)24)17(12)25)18(26)15(20)19(3,4)8-7-14(20)29-11(2)23/h12-15,17-18,25-27H,1,5-9H2,2-4H3
0 references
InChIKey
DJQLJZNVICMJRV-UHFFFAOYSA-N
0 references
PubChem CID
429192
2 references
stated in
PubChem
retrieved
26 December 2021
inferred from
InChIKey
matched by identifier from
InChIKey
InChIKey
DJQLJZNVICMJRV-UHFFFAOYSA-N
UniChem compound ID
32046212
1 reference
stated in
UniChem
DSSTox substance ID
DTXSID30951576
1 reference
matched by identifier from
InChIKey
InChIKey
DJQLJZNVICMJRV-UHFFFAOYSA-N
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