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(Q104989113)
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English
[2-[4,8-diacetyloxy-4a-(acetyloxymethyl)-1,2-dimethylspiro[3,4,6,7,8,8a-hexahydro-2H-naphthalene-5,2'-oxirane]-1-yl]-1-(5-oxo-2H-furan-3-yl)ethyl] 2-methylpropanoate
group of stereoisomers with the chemical formula C₃₀H₄₂O₁₁
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Statements
instance of
group of stereoisomers
0 references
subclass of
clerodane diterpenoid
1 reference
inferred from
clerodane diterpenoid
mass
578.272712164
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₃₀H₄₂O₁₁
0 references
canonical SMILES
O=C1OCC(=C1)C(OC(=O)C(C)C)CC2(C)C(C)CC(OC(=O)C)C3(COC(=O)C)C2C(OC(=O)C)CCC43OC4
0 references
found in taxon
Ajuga macrosperma
1 reference
stated in
Neo-clerodane diterpenoids from ajuga macrosperma and ajuga pantantha
Identifiers
InChI
InChI=1S/C30H42O11/c1-16(2)27(35)41-23(21-11-25(34)36-13-21)12-28(7)17(3)10-24(40-20(6)33)30(15-37-18(4)31)26(28)22(39-19(5)32)8-9-29(30)14-38-29/h11,16-17,22-24,26H,8-10,12-15H2,1-7H3
0 references
InChIKey
DTZSBKZSJBDDLI-UHFFFAOYSA-N
0 references
PubChem CID
163022830
2 references
stated in
PubChem
retrieved
2 January 2023
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
DTZSBKZSJBDDLI-UHFFFAOYSA-N
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