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(Q104979382)
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English
[3-Acetyloxy-9,10-dihydroxy-6-(methoxymethyl)-12-methyl-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 C₂₅H₃₆O₉
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Statements
instance of
group of stereoisomers
0 references
subclass of
kaurane diterpenoid
1 reference
inferred from
kaurane diterpenoid
mass
480.235932732
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₂₅H₃₆O₉
0 references
canonical SMILES
O=C(OCC1(C)CCCC23COC(O)(C(O)C12)C45C(=O)C(COC)C(CC(OC(=O)C)C43)C5)C
0 references
found in taxon
Isodon adenolomus
2 references
stated in
Structure and cytotoxicity of diterpenoids from Isodon adenolomus
stated in
Cytotoxic ent-kaurane diterpenoids from Isodon sinuolata
Identifiers
InChI
InChI=1S/C25H36O9/c1-13(26)32-11-22(3)6-5-7-23-12-33-25(30,21(29)19(22)23)24-9-15(16(10-31-4)20(24)28)8-17(18(23)24)34-14(2)27/h15-19,21,29-30H,5-12H2,1-4H3
0 references
InChIKey
DGVZXNNCLWTOAG-UHFFFAOYSA-N
0 references
PubChem CID
77916062
2 references
stated in
PubChem
retrieved
17 September 2022
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
DGVZXNNCLWTOAG-UHFFFAOYSA-N
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