Misplaced Pages:WikiProject Chemicals/Chembox validation/VerifiedDataSandbox

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Revision as of 13:41, 23 November 2011 by Beetstra (talk | contribs) (Saving copy of the {{chembox}} taken from revid 456589690 of page Medroxyprogesterone for the Chem/Drugbox validation project (updated: 'ChEMBL').)(diff) ← Previous revision | Latest revision (diff) | Newer revision → (diff)

This page contains a copy of the infobox ({{chembox}}) taken from revid 456589690 of page Medroxyprogesterone with values updated to verified values.

WikiProject Chemicals/Chembox validation/VerifiedDataSandbox
Names

IUPAC name 17-acetyl-17-hydroxy- 6,10,13-trimethyl- 1,2,6,7,8,9,10,11,12,13,14,15,16,17- tetradecahydrocyclopentaphenanthren-3-one
Identifiers
CAS Number	520-85-4
3D model (JSmol)	Interactive image
ChEBI	CHEBI:6715
ChemSpider	10185
DrugBank	DB00603
KEGG	D08166
PubChem CID	10631
UNII	HSU1C9YRES
InChI InChI=1S/C22H32O3/c1-13-11-16-17(20(3)8-5-15(24)12-19(13)20)6-9-21(4)18(16)7-10-22(21,25)14(2)23/h12-13,16-18,25H,5-11H2,1-4H3/t13-,16+,17-,18-,20+,21-,22-/m0/s1Key: FRQMUZJSZHZSGN-HBNHAYAOSA-N InChI=1/C22H32O3/c1-13-11-16-17(20(3)8-5-15(24)12-19(13)20)6-9-21(4)18(16)7-10-22(21,25)14(2)23/h12-13,16-18,25H,5-11H2,1-4H3/t13-,16+,17-,18-,20+,21-,22-/m0/s1Key: FRQMUZJSZHZSGN-HBNHAYAOBM
SMILES O=C4\C=C2/(1CC3((O)(C(=O)C)CC31C2C)C)(C)CC4
Properties
Chemical formula	C₂₂H₃₂O₃
Molar mass	344.488 g/mol
Except where otherwise noted, data are given for materials in their standard state (at 25 °C , 100 kPa). N verify (what is ?) Infobox references

Tracking categories (test):

Chemical compound