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c[G(2',5')pA(2',5')p]

PropertiesImage
MNX_IDMNXM153041 Image of MNXM153041
referencechebi:75948
formulaC20H24N10O13P2
global charge0
mol weight674.417
InChIKeyBQZWXNITEWDGCM-INFSMZHSSA-N
InChIInChI=1S/C20H24N10O13P2/c21-14-8-15(24-3-23-14)29(4-25-8)18-12-10(31)6(40-18)1-38-45(36,37)43-13-11(32)7(2-39-44(34,35)42-12)41-19(13)30-5-26-9-16(30)27-20(22)28-17(9)33/h3-7,10-13,18-19,31-32H,1-2H2,(H,34,35)(H,36,37)(H2,21,23,24)(H3,22,27,28,33)/t6-,7-,10-,11-,12-,13-,18-,19-/m1/s1
SMILESNC1=NC2=C(N=CN2[C@@H]2O[C@@H]3COP(=O)(O)O[C@@H]4[C@H](O)[C@@H](COP(=O)(O)O[C@@H]2[C@@H]3O)O[C@H]4N2C=NC3=C(N)N=CN=C32)C(=O)N1
MNX internals
InChI (mnx)InChI=1/C20H24N10O13P2/c21-14-8-15(24-3-23-14)29(4-25-8)18-12-10(31)6(40-18)1-38-45(36,37)43-13-11(32)7(2-39-44(34,35)42-12)41-19(13)30-5-26-9-16(30)27-20(22)28-17(9)33/h3-7,10-13,18-19,31-32H,1-2H2,(H,34,35)(H,36,37)(H2,21,23,24)(H3,22,27,28,33)/t6-,7-,10-,11-,12-,13-,18-,19-/m1/s1 Image of MNXM153041
SMILES (mnx)[CH2:1]1[C@@H:6]2[C@@H:10]([OH:31])[C@H:12]([C@H:18]([N:29]3[CH:4]=[N:25][C:8]4=[C:14]([NH2:21])[N:23]=[CH:3][N:24]=[C:15]43)[O:40]2)[O:42][P:44]([OH:34])(=[O:35])[O:39][CH2:2][C@@H:7]2[C@@H:11]([OH:32])[C@H:13]([C@H:19]([N:30]3[CH:5]=[N:26][C:9]4=[C:16]3[NH:27][C:20](=[NH:22])[N:28]=[C:17]4[OH:33])[O:41]2)[O:43][P:45]([OH:36])(=[O:37])[O:38]1
Parent-child relations graph
Occurences in reactions#reac
in my sandbox 0
in MNXref (generic)0
in models (compartimentalized) 0
Similar chemical compounds in external resources
IdentifierDescription

CHEBI:75948
chebi:75948
BQZWXNITEWDGCM-INFSMZHSSA-N
c[G(2',5')pA(2',5')p]
2',5'-cyclic GMP-AMP
2-amino-9-[(1R,6R,8R,9R,14R,16R,17R,18R)-16-(6-amino-9H-purin-9-yl)-3,11,17,18-tetrahydroxy-3,11-dioxido-2,4,7,10,12,15-hexaoxa-3,11-diphosphatricyclo[12.2.1.1(6,9)]octadec-8-yl]-1,9-dihydro-6H-purin-6-one

metacyc.compound:CPD-25750
metacycM:CPD-25750
BQZWXNITEWDGCM-INFSMZHSSA-L
2',2'-cyclic GMP-AMP
2',5'-cyclic GMP-AMP
2-amino-9-[(1R,6R,8R,9R,14R,16R,17R,18R)-16-(6-amino-9H-purin-9-yl)-3,11,17,18-tetrahydroxy-3,11-dioxido-2,4,7,10,12,15-hexaoxa-3,11-diphosphatricyclo[12.2.1.1(6,9)]octadec-8-yl]-1,9-dihydro-6H-purin-6-one
c[G(2',5')pA(2',5')p]