PDB CCD ID: | IB2 | ||||||||||
Number of entries in BioLiP: | 2 | ||||||||||
Chemical formula: | C21 H29 N10 O14 P3 S | ||||||||||
InChI: | InChI=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 | ||||||||||
InChIKey: | UJCWOSLCGXVJOD-LCHUORCTSA-N | ||||||||||
SMILES: |
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Name: | P1-P2-METHYLENE-P3-THIO-DIADENOSINE TRIPHOSPHATE; ADO-P-CH2-P-PS-ADO | ||||||||||
DrugBank: | DB04389 |