Misplaced Pages:WikiProject Chemicals/Chembox validation/VerifiedDataSandbox

This is an old revision of this page, as edited by Beetstra (talk | contribs) at 15:24, 16 November 2011 (Saving copy of the {{drugbox}} taken from revid 460953303 of page Tigecycline for the Chem/Drugbox validation project (updated: 'DrugBank').). The present address (URL) is a permanent link to this revision, which may differ significantly from the current revision.

Revision as of 15:24, 16 November 2011 by Beetstra (talk | contribs) (Saving copy of the {{drugbox}} taken from revid 460953303 of page Tigecycline for the Chem/Drugbox validation project (updated: 'DrugBank').)(diff) ← Previous revision | Latest revision (diff) | Newer revision → (diff)

This page contains a copy of the infobox ({{drugbox}}) taken from revid 460953303 of page Tigecycline with values updated to verified values.

WikiProject Chemicals/Chembox validation/VerifiedDataSandbox
Clinical data

Trade names	Tygacil
Other names	N--2-(tert-butylamino)acetamide
AHFS/Drugs.com	Monograph
Pregnancy category	AU: D
Routes of administration	IV only
ATC code	J01AA12 (WHO)
Legal status
Legal status	AU: S4 (Prescription only) US: ℞-only
Pharmacokinetic data
Bioavailability	NA
Protein binding	71-89%
Metabolism	not metabolised
Elimination half-life	42.4 hours
Excretion	59% biliary, 33% renal
Identifiers
IUPAC name N--4,7-bis(dimethylamino)-1,10a,12-trihydroxy-8,10,11-trioxo-5,5a,6,6a,7,8,9,10,10a,11-decahydrotetracen-2-yl]-2-(tert-butylamino)acetamide
CAS Number	220620-09-7
PubChem CID	5282044
DrugBank	DB00560
ChemSpider	10482314
UNII	70JE2N95KR
KEGG	D01079
ChEBI	CHEBI:149836
ChEMBL	ChEMBL376140
Chemical and physical data
Formula	C₂₉H₃₉N₅O₈
Molar mass	585.65 g/mol g·mol
3D model (JSmol)	Interactive image
SMILES CC(C)(C)NCC(=O)Nc1cc(c2C3C4(N(C)C)C(\O)=C(\C(N)=O)C(=O)4(O)C(/O)=C3/C(=O)c2c1O)N(C)C
InChI InChI=1S/C29H39N5O8/c1-28(2,3)31-11-17(35)32-15-10-16(33(4)5)13-8-12-9-14-21(34(6)7)24(38)20(27(30)41)26(40)29(14,42)25(39)18(12)23(37)19(13)22(15)36/h10,12,14,21,31,36,38-39,42H,8-9,11H2,1-7H3,(H2,30,41)(H,32,35)/t12-,14-,21-,29-/m0/s1 Key:FPZLLRFZJZRHSY-HJYUBDRYSA-N
(what is this?) (verify)