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tenofovir alafenamide fumarate

Properties

Image

Occurences in reactions

MNX_ID

MNXM161450

	#reac
in my sandbox	0
in MNXref (generic)	0
in models (compartimentalized)	0

formula

C₄₆H₆₂N₁₂O₁₄P₂

charge

mass

1068.39837

reference

chebi:90923

InChIKey

SVUJNSGGPUCLQZ-FQQAACOVSA-N

InChI

InChI=1S/2C21H29N6O5P.C4H4O4/c2*1-14(2)31-21(28)16(4)26-33(29,32-17-8-6-5-7-9-17)13-30-15(3)10-27-12-25-18-19(22)23-11-24-20(18)27;5-3(6)1-2-4(7)8/h2*5-9,11-12,14-16H,10,13H2,1-4H3,(H,26,29)(H2,22,23,24);1-2H,(H,5,6)(H,7,8)/b;;2-1+/t2*15-,16+,33+;/m11./s1

SMILES

CC(C)OC(=O)[C@H](C)N[P@](=O)(CO[C@H](C)Cn1cnc2c(N)ncnc21)Oc1ccccc1.CC(C)OC(=O)[C@H](C)N[P@](=O)(CO[C@H](C)Cn1cnc2c(N)ncnc21)Oc1ccccc1.O=C(O)/C=C/C(=O)O

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Similar chemical compounds in external resources
Identifier	Description
CHEBI:90923 chebi:90923	tenofovir alafenamide fumarate GS-7340-03 TAF Vemlidy bis{9-[(2R,5S,7E)-2,7,10-trimethyl-5,8-dioxo-5-phenoxy-3,9-dioxa-6-aza-5lambda5-phosphaundecan-1-yl]-9H-purin-6-aminium} (2E)-but-2-enedioate bis{propan-2-yl N-[(S)-({[(2R)-1-(6-amino-9H-purin-9-yl)propan-2-yl]oxy}methyl)(phenoxy)phosphoryl]-L-alaninate} (2E)-but-2-enedioate tenofovir alafenamide hemifumarate
kegg.drug:D10605 keggD:D10605	Tenofovir alafenamide fumarate (USAN/JAN) ABBR TAF Vemlidy (TN)
keggD:M_D10605	secondary/obsolete/fantasy identifier