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aurodrosopterin

MNXM148956 is deprecated and here replaced by MNXM1363689
!!! Alternative mappings exist !!!
PropertiesImage
MNX_IDMNXM1363689 Image of MNXM1363689
referencemetacycM:CPD-16457
formulaC15H15N9O3
global charge0
mol weight369.345
InChIKeyTWJXLQJAXSHJQU-UHFFFAOYSA-N
InChIInChI=1S/C15H15N9O3/c1-4-7-5(2-17-10-8(19-7)12(25)22-14(16)20-10)6-3-18-11-9(24(4)6)13(26)23-15(27)21-11/h5-6H,2-3H2,1H3,(H3,16,17,20,22,25)(H3,18,21,23,26,27)
SMILESCC1=C2N=C3C(=O)N=C(N)NC3=NCC2C2CNC3=C(C(=O)N=C(O)N3)N12
MNX internals
InChI (mnx)InChI=1/C15H15N9O3/c1-4-7-5(2-17-10-8(19-7)12(25)22-14(16)20-10)6-3-18-11-9(24(4)6)13(26)23-15(27)21-11/h5-6H,2-3H2,1H3,(H3,16,17,20,22,25)(H3,18,21,23,26,27)/t5?,6? Image of MNXM1363689
SMILES (mnx)[CH3:1][C:4]1=[C:7]2[CH:5]([CH2:2][N:17]=[C:10]3[C:8](=[N:19]2)[C:12]([OH:25])=[N:22][C:14](=[NH:16])[NH:20]3)[CH:6]2[CH2:3][NH:18][C:11]3=[C:9]([C:13]([OH:26])=[N:23][C:15]([OH:27])=[N:21]3)[N:24]12
Parent-child relations graph
Occurences in reactions#reac
in my sandbox 0
in MNXref (generic)1
in models (compartimentalized) 0
Similar chemical compounds in external resources
IdentifierDescription

metacyc.compound:CPD-16457
metacycM:CPD-16457
TWJXLQJAXSHJQU-UHFFFAOYSA-N 		aurodrosopterin