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CHEBI:43354 - P1-P2-METHYLENE-P3-THIO-DIADENOSINE TRIPHOSPHATE

Default Structure
ChEBI IDCHEBI:43354
ChEBI NameP1-P2-METHYLENE-P3-THIO-DIADENOSINE TRIPHOSPHATE
Stars
DownloadsMolfile
FormulaC21H29N10O14P3S
Net Charge0
Average Mass770.508
Monoisotopic Mass770.07983
SMILES[H]O[C@@]1([H])[C@@]([H])(O[H])[C@]([H])(n2c([H])nc3c(N([H])[H])nc([H])nc32)O[C@]1([H])C([H])([H])O[P@](=O)(O[P@@](=O)(O[H])C([H])([H])[P@](=O)(O[H])OC([H])([H])[C@@]1([H])O[C@@]([H])(n2c([H])nc3c(N([H])[H])nc([H])nc32)[C@]([H])(O[H])[C@]1([H])O[H])S[H]
InChIInChI=1S/C21H29N10O14P3S/c22-16-10-18(26-3-24-16)30(5-28-10)20-14(34)12(32)8(43-20)1-41-46(36,37)7-47(38,39)45-48(40,49)42-2-9-13(33)15(35)21(44-9)31-6-29-11-17(23)25-4-27-19(11)31/h3-6,8-9,12-15,20-21,32-35H,1-2,7H2,(H,36,37)(H,38,39)(H,40,49)(H2,22,24,26)(H2,23,25,27)/t8-,9-,12-,13-,14-,15-,20-,21-,48-/m1/s1
InChIKeyUJCWOSLCGXVJOD-LCHUORCTSA-N
ChEBI Ontology
Outgoing Relation(s)
P1-P2-METHYLENE-P3-THIO-DIADENOSINE TRIPHOSPHATE (CHEBI:43354) is a unclassifieds (CHEBI:27189)
Synonym  Source
P1-P2-METHYLENE-P3-THIO-DIADENOSINE TRIPHOSPHATEPDBeChem
Manual XrefsDatabases
IB2PDBeChem