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(Q104982878)
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English
5,18-dihydroxy-15-(methoxycarbonyl)-20-methyl-17-oxa-1,11-diazapentacyclo[10.8.1.0²,⁷.0⁸,²¹.0¹⁴,¹⁹]henicosa-2(7),3,5,8(21),9,11,15-heptaene-10-carboxylic acid
group of stereoisomers with the chemical formula C₂₂H₂₀N₂O₇
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Statements
instance of
group of stereoisomers
0 references
subclass of
alkaloid
1 reference
inferred from
alkaloid
mass
424.4042
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₂₂H₂₀N₂O₇
0 references
canonical SMILES
O=C(O)C=1N=C2C3=C(C1)C=4C=C(O)C=CC4N3C(C)C5C(O)OC=C(C(=O)OC)C5C2
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Identifiers
InChI
InChI=1S/C22H20N2O7/c1-9-18-12(14(21(28)30-2)8-31-22(18)29)6-15-19-13(7-16(23-15)20(26)27)11-5-10(25)3-4-17(11)24(9)19/h3-5,7-9,12,18,22,25,29H,6H2,1-2H3,(H,26,27)
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InChIKey
DJWXVEDJWPDUBQ-UHFFFAOYSA-N
0 references
CAS Registry Number
20072-28-0
1 reference
stated in
CAS (formerly Chemical Abstracts Service)
retrieved
25 January 2022
PubChem CID
5087852
2 references
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
DJWXVEDJWPDUBQ-UHFFFAOYSA-N
UniChem compound ID
49538005
1 reference
stated in
UniChem
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