PDB CCD ID: | 138 | ||||||||||||
Number of entries in BioLiP: | 4 | ||||||||||||
Chemical formula: | C30 H37 N6 O15 P | ||||||||||||
InChI: | InChI=1S/C30H37N6O15P/c31-29-34-18-6-1-14(9-17(18)26(43)36-29)10-30(46,16-4-2-15(3-5-16)25(42)33-19(28(44)45)7-8-22(38)39)13-32-11-21(37)35-27-24(41)23(40)20(51-27)12-50-52(47,48)49/h1-6,9,19-20,23-24,27,32,40-41,46H,7-8,10-13H2,(H,33,42)(H,35,37)(H,38,39)(H,44,45)(H2,47,48,49)(H3,31,34,36,43)/t19-,20+,23+,24+,27+,30+/m0/s1 | ||||||||||||
InChIKey: | QZUCAWXKEZPFBV-PRICPSHJSA-N | ||||||||||||
SMILES: |
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Name: | N-[5'-O-PHOSPHONO-RIBOFURANOSYL]-2-[2-HYDROXY-2-[4-[GLUTAMIC ACID]-N-CARBONYLPHENYL]-3-[2-AMINO-4-HYDROXY-QUINAZOLIN-6-YL]-PROPANYLAMINO]-ACETAMIDE | ||||||||||||
DrugBank: | DB02794 | ||||||||||||
ZINC: | ZINC000098207915 |