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(Q104667559)
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English
(3,9,10,15-Tetrahydroxy-12-methyl-6-methylidene-7-oxo-17-oxapentacyclo[7.6.2.15,8.01,11.02,8]octadecan-12-yl)methyl acetate
group of stereoisomers with the chemical formula C₂₂H₃₀O₈
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Statements
instance of
group of stereoisomers
0 references
subclass of
kaurane diterpenoid
1 reference
inferred from
kaurane diterpenoid
mass
422.19406792
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₂₂H₃₀O₈
0 references
canonical SMILES
O=C(OCC1(C)CCC(O)C23COC(O)(C(O)C12)C45C(=O)C(=C)C(CC(O)C43)C5)C
0 references
found in taxon
Isodon adenolomus
4 references
stated in
Structure and cytotoxicity of diterpenoids from Isodon adenolomus
stated in
Cytotoxic ent-kaurane diterpenoids from Isodon sinuolata
stated in
Diterpenoids from Isodon enanderianus
stated in
ent-Kaurene diterpenoids from Isodon oresbius.
Identifiers
InChI
InChI=1S/C22H30O8/c1-10-12-6-13(24)15-20-9-30-22(28,21(15,7-12)17(10)26)18(27)16(20)19(3,5-4-14(20)25)8-29-11(2)23/h12-16,18,24-25,27-28H,1,4-9H2,2-3H3
0 references
InChIKey
WCTFNFXLZNQINE-UHFFFAOYSA-N
0 references
PubChem CID
77916064
2 references
stated in
PubChem
retrieved
17 September 2022
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
WCTFNFXLZNQINE-UHFFFAOYSA-N
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