MetaNetX
Automated Model Construction and Genome Annotation for Large-Scale Metabolic Networks

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2',3'-cyclophospho-AMP

	Properties	Image
MNX_ID	MNXM2598
reference	chebi:60879
formula	C₁₀H₁₁N₅O₆P
global charge	-1
mol weight	328.201
InChIKey	KMYWVDDIPVNLME-KQYNXXCUSA-M
InChI	InChI=1S/C10H12N5O6P/c11-8-5-9(13-2-12-8)15(3-14-5)10-7-6(4(1-16)19-10)20-22(17,18)21-7/h2-4,6-7,10,16H,1H2,(H,17,18)(H2,11,12,13)/p-1/t4-,6-,7-,10-/m1/s1
SMILES	NC1=NC=NC2=C1N=CN2[C@@H]1O[C@H](CO)[C@H]2OP(=O)([O-])O[C@H]21

MNX internals

InChI (mnx)	InChI=1/C10H12N5O6P/c11-8-5-9(13-2-12-8)15(3-14-5)10-7-6(4(1-16)19-10)20-22(17,18)21-7/h2-4,6-7,10,16H,1H2,(H,17,18)(H2,11,12,13)/t4-,6-,7-,10-/m1/s1
SMILES (mnx)	[CH2:1]([C@@H:4]1[C@@H:6]2[C@H:7]([C@H:10]([N:15]3[CH:3]=[N:14][C:5]4=[C:8]([NH2:11])[N:12]=[CH:2][N:13]=[C:9]43)[O:19]1)[O:21][P:22]([OH:17])(=[O:18])[O:20]2)[OH:16]

Parent-child relations graph

Occurences in reactions	#reac
in my sandbox	0
in MNXref (generic)	5
in models (compartimentalized)	7

Similar chemical compounds in external resources
Identifier	Description
CHEBI:60879 chebi:60879 KMYWVDDIPVNLME-KQYNXXCUSA-M	2',3'-cyclophospho-AMP 2',3'-cyclic AMP(1-) adenosine 2',3'-phosphate
bigg.metabolite:23camp biggM:23camp sabiork.compound:1882 sabiorkM:1882 kegg.compound:C02353 keggC:C02353 KMYWVDDIPVNLME-KQYNXXCUSA-N KMYWVDDIPVNLME-UHFFFAOYSA-M	2',3'-Cyclic AMP
seed.compound:cpd01570 seedM:cpd01570 KMYWVDDIPVNLME-KQYNXXCUSA-M	2',3'-Cyclic AMP (2R,3aR,4R,6R,6aR)-4-(6-amino-9H-purin-9-yl)-6-(hydroxymethyl)tetrahydrofuro[3,4-d][1,3,2]dioxaphosphol-2-ol 2-oxide (3aR,4R,6R,6aR)-4-(6-amino-9H-purin-9-yl)-6-(hydroxymethyl)tetrahydrofuro[3,4-d][1,3,2]dioxaphosphol-2-ol 2-oxide 23camp adenosine 2',3'-(hydrogen phosphate) adenosine 2',3'-cyclic monophosphate adenosine 2'3'-cyclic monophosphate adenosine cyclic 2',3'-(hydrogen phosphate) cyclic 2',3'-AMP cyclic 2',3'-adenosine monophosphate
CHEBI:27844 chebi:27844 KMYWVDDIPVNLME-KQYNXXCUSA-N	2',3'-cyclic AMP (3aR,4R,6R,6aR)-4-(6-amino-9H-purin-9-yl)-6-(hydroxymethyl)tetrahydrofuro[3,4-d][1,3,2]dioxaphosphol-2-ol 2-oxide 2',3'-Cyclic AMP adenosine 2',3'-(hydrogen phosphate) adenosine cyclic 2',3'-(hydrogen phosphate)
vmhM:23camp vmhmetabolite:23camp KMYWVDDIPVNLME-UHFFFAOYSA-M	2,3-Cyclic AMP
hmdb:HMDB0011616 KMYWVDDIPVNLME-UHFFFAOYSA-N	Adenosine 2',3'-cyclic phosphate 2',3'-CAMP 2',3'-Cyclic AMP 2',3'-Cyclic AMP, monosodium salt 2',3'-Cyclic AMP, sodium salt 2',3'-Cyclic adenosine monophosphate 4-(6-amino-9H-purin-9-yl)-2-hydroxy-6-(hydroxymethyl)-tetrahydro-2H-2lambda⁵-furo[3,4-d][1,3,2]dioxaphosphol-2-one 4-(6-aminopurin-9-yl)-2-hydroxy-6-(hydroxymethyl)-tetrahydro-2lambda⁵-furo[3,4-d][1,3,2]dioxaphosphol-2-one Adenosine 2',3'-cyclic phosphoric acid Adenosine cyclic 2',3'-monophosphate Adenosine cyclic 2,3 monophosphate Adenosine cyclic-2',3'-monophosphate Cyclic 2',3'-(hydrogen phosphate)-adenosine Cyclic 2',3'-AMP D-Altro-heptulose D-Altroheptulose D-Sedoheptulose Volemulose b-D-Sedoheptulopyranose b-D-Sedoheptulose beta-D-Altro-2-heptulopyranose beta-D-Sedoheptulopyranose beta-D-Sedoheptulose beta-D-altro-2-heptulopyranose beta-D-sedoheptulopyranose beta-D-sedoheptulose
CHEBI:175195 chebi:175195 KMYWVDDIPVNLME-UHFFFAOYSA-N	Adenosine 2',3'-cyclic phosphate [4-(6-aminopurin-9-yl)-2-hydroxy-2-oxo-3a,4,6,6a-tetrahydrouro[3,4-d][1,3,2]dioxaphosphol-6-yl]methanol
CHEBI:181562 chebi:181562 KMYWVDDIPVNLME-UHFFFAOYSA-M	[4-(6-Aminopurin-9-yl)-2-oxido-2-oxo-3a,4,6,6a-tetrahydrofuro[3,4-d][1,3,2]dioxaphosphol-6-yl]methanol [4-(6-aminopurin-9-yl)-2-oxido-2-oxo-3a,4,6,6a-tetrahydrouro[3,4-d][1,3,2]dioxaphosphol-6-yl]methanol
metacyc.compound:CPD-3707 metacycM:CPD-3707 KMYWVDDIPVNLME-KQYNXXCUSA-M	adenosine 2',3'-cyclic monophosphate (2R,3aR,4R,6R,6aR)-4-(6-amino-9H-purin-9-yl)-6-(hydroxymethyl)tetrahydrofuro[3,4-d][1,3,2]dioxaphosphol-2-ol 2-oxide (3aR,4R,6R,6aR)-4-(6-amino-9H-purin-9-yl)-6-(hydroxymethyl)tetrahydrofuro[3,4-d][1,3,2]dioxaphosphol-2-ol 2-oxide 2',3'-Cyclic AMP adenosine 2',3'-(hydrogen phosphate) adenosine cyclic 2',3'-(hydrogen phosphate) cyclic 2',3'-AMP cyclic 2',3'-adenosine monophosphate
hmdb:HMDB11616 chebi:19212 chebi:40469 chebi:823 biggM:M_23camp keggC:M_C02353 seedM:M_cpd01570 vmhM:M_23camp	secondary/obsolete/fantasy identifier