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SGE

Summary
Name:13-methyl-13,14-dihydro[1,3]benzodioxolo[5,6-c][1,3]dioxolo[4,5-i]phenanthridine
Formula:C20 H15 N O4
Formal charge:0
Formula weight:333.337 Da
Component type:NON-POLYMER
Ambiguous Chemistry Warning:The chemical description of this component is not well described in this definition. Descriptors and chemical names should be used with caution.

Chemical Descriptors

TypeProgramVersionDescriptor
SMILES_CANONICALCACTVS3.352CN1Cc2c3OCOc3ccc2c4ccc5cc6OCOc6cc5c14
SMILESCACTVS3.352CN1Cc2c3OCOc3ccc2c4ccc5cc6OCOc6cc5c14
SMILES_CANONICALOpenEye OEToolkits1.7.0C[N@@]1Cc2c(ccc3c2OCO3)-c4c1c5cc6c(cc5cc4)OCO6
SMILESOpenEye OEToolkits1.7.0CN1Cc2c(ccc3c2OCO3)-c4c1c5cc6c(cc5cc4)OCO6
InChIInChI1.03InChI=1S/C20H15NO4/c1-21-8-15-12(4-5-16-20(15)25-10-22-16)13-3-2-11-6-17-18(24-9-23-17)7-14(11)19(13)21/h2-7H,8-10H2,1H3
InChIKeyInChI1.03CIUHLXZTZWTVFL-UHFFFAOYSA-N

218500

PDB entries from 2024-04-17

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