PDB CCD ID: | BF0 | ||||||||||||
Number of entries in BioLiP: | 1 | ||||||||||||
Chemical formula: | C25 H32 N2 O6 | ||||||||||||
InChI: | InChI=1S/C25H32N2O6/c1-32-20(30)7-6-19(29)26-16-8-9-25(31)18-12-15-4-5-17(28)22-21(15)24(25,23(16)33-22)10-11-27(18)13-14-2-3-14/h4-5,14,16,18,23,28,31H,2-3,6-13H2,1H3,(H,26,29)/t16-,18-,23+,24+,25-/m1/s1 | ||||||||||||
InChIKey: | PGIBGSVRAVGQMY-OIUZVZFJSA-N | ||||||||||||
SMILES: |
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Name: | methyl 4-{[(5beta,6alpha)-17-(cyclopropylmethyl)-3,14-dihydroxy-4,5-epoxymorphinan-6-yl]amino}-4-oxobutanoate; beta-funaltrexamine, bound form | ||||||||||||
ZINC: | ZINC000095921301 |