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hydrodidemethylasterriquinone D

MNXM148280 is deprecated and here replaced by MNXM1363712
!!! Alternative mappings exist !!!
PropertiesImage
MNX_IDMNXM1363712 Image of MNXM1363712
referencemetacycM:CPD-16848
formulaC22H16N2O4
global charge-2
mol weight372.38
InChIKeyMSBVTJUYXQZLBV-UHFFFAOYSA-L
InChIInChI=1S/C22H18N2O4/c25-19-17(13-9-23-15-7-3-1-5-11(13)15)20(26)22(28)18(21(19)27)14-10-24-16-8-4-2-6-12(14)16/h1-10,19,22-28H/p-2
SMILES[O-]C1=C(C2=CNC3=CC=CC=C32)C(O)C([O-])=C(C2=CNC3=CC=CC=C32)C1O
MNX internals
InChI (mnx)InChI=1/C22H18N2O4/c25-19-17(13-9-23-15-7-3-1-5-11(13)15)20(26)22(28)18(21(19)27)14-10-24-16-8-4-2-6-12(14)16/h1-10,19,22-28H/t19?,22? Image of MNXM1363712
SMILES (mnx)[CH:1]1=[CH:3][CH:7]=[C:15]2[C:11](=[CH:5]1)[C:13]([C:17]1=[C:20]([OH:26])[CH:22]([OH:28])[C:18]([C:14]3=[CH:10][NH:24][C:16]4=[CH:8][CH:4]=[CH:2][CH:6]=[C:12]34)=[C:21]([OH:27])[CH:19]1[OH:25])=[CH:9][NH:23]2
Parent-child relations graph
Occurences in reactions#reac
in my sandbox 0
in MNXref (generic)2
in models (compartimentalized) 0
Similar chemical compounds in external resources
IdentifierDescription

metacyc.compound:CPD-16848
metacycM:CPD-16848
MSBVTJUYXQZLBV-UHFFFAOYSA-L 		hydrodidemethylasterriquinone D