CHEBI:192533 - A[3'-5']pG[3'-5']pAp[3'](4−)

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This entity has been annotated by a third party. If you would like more information added to this entry, please contact ChEBI via email or GitHub.
ChEBI Name A[3'-5']pG[3'-5']pAp[3'](4−)
ChEBI ID CHEBI:192533
ChEBI ASCII Name A[3'-5']pG[3'-5']pAp[3'](4-)
Definition Major microspecies at pH 7.3
Stars This entity has been manually annotated by a third party.
Submitter Anne Morgat
Supplier Information
Download Molfile XML SDF
Formula C30H34N15O20P3
Net Charge -4
Average Mass 1017.610
Monoisotopic Mass 1017.13393
InChI InChI=1S/C30H38N15O20P3/c31-21-12-23(36-4-34-21)43(6-38-12)27-15(47)18(9(1-46)60-27)64-67(54,55)59-3-11-20(17(49)29(62-11)45-8-40-14-25(45)41-30(33)42-26(14)50)65-68(56,57)58-2-10-19(63-66(51,52)53)16(48)28(61-10)44-7-39-13-22(32)35-5-37-24(13)44/h4-11,15-20,27-29,46-49H,1-3H2,(H,54,55)(H,56,57)(H2,31,34,36)(H2,32,35,37)(H2,51,52,53)(H3,33,41,42,50)/p-4/t9-,10-,11-,15-,16-,17-,18-,19-,20-,27-,28-,29-/m1/s1
InChIKey OVMDAUZWXHEDLO-ZQWUJQRXSA-J
SMILES [C@@H]1(N2C3=C(C(N)=NC=N3)N=C2)O[C@@H]([C@H]([C@H]1O)OP(=O)([O-])[O-])COP(O[C@@H]4[C@H](O[C@@H](N5C6=C(C(=O)NC(=N6)N)N=C5)[C@@H]4O)COP(O[C@@H]7[C@H](O[C@@H](N8C9=C(C(N)=NC=N9)N=C8)[C@@H]7O)CO)([O-])=O)(=O)[O-]
ChEBI Ontology
Outgoing A[3'-5']pG[3'-5']pAp[3'](4−) (CHEBI:192533) is a oligonucleotide (CHEBI:7754)
A[3'-5']pG[3'-5']pAp[3'](4−) (CHEBI:192533) is a organophosphate oxoanion (CHEBI:58945)
Synonym Source
A[3'-5']pG[3'-5']pAp[3'] UniProt