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(Q110080398)
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English
[14-Hydroxy-18,19-dimethoxy-13,14-dimethyl-12-(2-methylbut-2-enoyloxy)-20-oxo-3,6,8-trioxapentacyclo[9.9.1.01,16.04,21.05,9]henicosa-4(21),5(9),10,18-tetraen-15-yl] benzoate
group of stereoisomers with the chemical formula C₃₄H₃₆O₁₁
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Statements
instance of
group of stereoisomers
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subclass of
chemical compound
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mass
620.225761972
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₃₄H₃₆O₁₁
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canonical SMILES
O=C(OC1C2CC(OC)=C(OC)C(=O)C32C4=C(OC3)C=5OCOC5C=C4C(OC(=O)C(=CC)C)C(C)C1(O)C)C=6C=CC=CC6
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found in taxon
Kadsura philippinensis
1 reference
stated in
Compounds from Kadsura heteroclita and related anti-HIV activity
Kadsura heteroclita
1 reference
stated in
Kadsuphilols A-H, oxygenated lignans from Kadsura philippinensis.
Identifiers
InChI
InChI=1S/C34H36O11/c1-7-17(2)31(36)44-25-18(3)33(4,38)30(45-32(37)19-11-9-8-10-12-19)21-14-22(39-5)27(40-6)29(35)34(21)15-41-28-24(34)20(25)13-23-26(28)43-16-42-23/h7-13,18,21,25,30,38H,14-16H2,1-6H3
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InChIKey
MEWXBVHFCDFAIG-UHFFFAOYSA-N
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PubChem CID
162849841
1 reference
stated in
PubChem
retrieved
17 September 2022
based on heuristic
inferred from InChIKey
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