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Revision as of 20:04, 16 February 2012 editBeetstra (talk | contribs)Edit filter managers, Administrators172,031 edits Saving copy of the {{chembox}} taken from revid 460121729 of page Actinidiolide for the Chem/Drugbox validation project (updated: 'StdInChI', 'StdInChIKey', 'CASNo').← Previous edit Revision as of 20:05, 16 February 2012 edit undoBeetstra (talk | contribs)Edit filter managers, Administrators172,031 edits Saving copy of the {{drugbox}} taken from revid 474862755 of page Actinomycin for the Chem/Drugbox validation project (updated: 'DrugBank', 'KEGG').Next edit →
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{{ambox | text = This page contains a copy of the infobox ({{tl|chembox}}) taken from revid of page ] with values updated to verified values.}} {{ambox | text = This page contains a copy of the infobox ({{tl|drugbox}}) taken from revid of page ] with values updated to verified values.}}
{{Chembox {{Drugbox
| Verifiedfields = changed | Verifiedfields = changed
⚫ | verifiedrevid = 457803653
| Watchedfields = changed
| IUPAC_name = 2-amino-''N,N<nowiki>'</nowiki>''- bis oxatetraazacyclohexadecin- 10-yl]- 4,6-dimethyl- 3-oxo- 3''H''-phenoxazine- 1,9-dicarboxamide
⚫ | verifiedrevid = 399373348
| image = Actinomycin D.png
| ImageFile = Actinidiolide chemical structure.png
| drug_name = Actinomycin D
⚫ | ImageFile_Ref = {{chemboximage|correct|??}}

| ImageSize = 121
<!--Clinical data-->
| ImageName = Skeletal formula of actinidiolide ((7a''R'')-7a-meth)
| tradename =
| IUPACName = 4,4,7a-Trimethyl-4,5-dihydrobenzofuran-2(7a''H'')-one
| MedlinePlus = a682224
| OtherNames = 4,4,7a-Trimethyl-5''H''-1-benzofuran-2-one
| pregnancy_category =
| Section1 = {{Chembox Identifiers
| legal_status =
⚫ | CASNo = <!-- blanked - oldvalue: 17063-17-1 -->
| routes_of_administration =
⚫ | CASNo_Ref = {{cascite|correct|??}}

| PubChem2 = 15558330
<!--Pharmacokinetic data-->
⚫ | PubChem2_Ref = {{Pubchemcite|correct| StdInChI_Ref = {{stdinchicite|correct|chemspider}}
| bioavailability =
| StdInChI = 1S/C11H14O2/c1-10(2)5-4-6-11(3)8(10)7-9(12)13-11/h4,6-7H,5H2,1-3H3/t11-/m0/s1
| protein_bound = 5%
| metabolism =
| elimination_half-life = 36 hours

<!--Identifiers-->
⚫ | CASNo_Ref = {{cascite|correct|CAS}}
⚫ | CAS_number_Ref = {{cascite|correct|??}}
| CAS_number = 50-76-0
| ATC_prefix = L01
| ATC_suffix = DA01
| ATC_supplemental =
⚫ | PubChem = 2019
| DrugBank_Ref = {{drugbankcite|changed|drugbank}}
| DrugBank = <!-- blanked - oldvalue: APRD00124 -->
⚫ | ChemSpiderID_Ref = {{chemspidercite|correct|chemspider}}
⚫ | ChemSpiderID = 10482167
| NIAID_ChemDB = 009885
| UNII_Ref = {{fdacite|correct|FDA}}
| UNII = 1CC1JFE158
| KEGG_Ref = {{keggcite|changed|kegg}}
⚫ | KEGG = <!-- blanked - oldvalue: C06770 -->
| ChEBI_Ref = {{ebicite|correct|EBI}}
| ChEBI = 27666
| ChEMBL_Ref = {{ebicite|correct|EBI}}
| ChEMBL = 1554

<!--Chemical data-->
| C=62 | H=86 | N=12 | O=16
| molecular_weight = 1255.42 g/mol
| InChI = 1/C62H86N12O16/c1-27(2)42-59(84)73-23-17-19-36(73)57(82)69(13)25-38(75)71(15)48(29(5)6)61(86)88-33(11)44(55(80)65-42)67-53(78)35-22-21-31(9)51-46(35)64-47-40(41(63)50(77)32(10)52(47)90-51)54(79)68-45-34(12)89-62(87)49(30(7)8)72(16)39(76)26-70(14)58(83)37-20-18-24-74(37)60(85)43(28(3)4)66-56(45)81/h21-22,27-30,33-34,36-37,42-45,48-49H,17-20,23-26,63H2,1-16H3,(H,65,80)(H,66,81)(H,67,78)(H,68,79)/t33-,34-,36+,37+,42-,43-,44+,45+,48+,49+/m1/s1
| InChIKey = RJURFGZVJUQBHK-IIXSONLDBN
⚫ | StdInChI_Ref = {{stdinchicite|correct|chemspider}}
| StdInChI = 1S/C62H86N12O16/c1-27(2)42-59(84)73-23-17-19-36(73)57(82)69(13)25-38(75)71(15)48(29(5)6)61(86)88-33(11)44(55(80)65-42)67-53(78)35-22-21-31(9)51-46(35)64-47-40(41(63)50(77)32(10)52(47)90-51)54(79)68-45-34(12)89-62(87)49(30(7)8)72(16)39(76)26-70(14)58(83)37-20-18-24-74(37)60(85)43(28(3)4)66-56(45)81/h21-22,27-30,33-34,36-37,42-45,48-49H,17-20,23-26,63H2,1-16H3,(H,65,80)(H,66,81)(H,67,78)(H,68,79)/t33-,34-,36+,37+,42-,43-,44+,45+,48+,49+/m1/s1
| StdInChIKey_Ref = {{stdinchicite|correct|chemspider}} | StdInChIKey_Ref = {{stdinchicite|correct|chemspider}}
| StdInChIKey = VGQSMHFBCKKQHB-NSHDSACASA-N | StdInChIKey = RJURFGZVJUQBHK-IIXSONLDSA-N
| synonyms = <small>2-Amino- 4,6-dimethyl- 3-oxo- 3H-phenoxazine- 1,9-dicarboxylic acid bis- </small>
| PubChem}}
| PubChem1 = 11062957
| PubChem1_Ref = {{Pubchemcite|correct| StdInChI_Ref = {{stdinchicite|correct|chemspider}}
| StdInChI = 1S/C11H14O2/c1-10(2)5-4-6-11(3)8(10)7-9(12)13-11/h4,6-7H,5H2,1-3H3/t11-/m0/s1
| StdInChIKey_Ref = {{stdinchicite|correct|chemspider}}
| StdInChIKey = VGQSMHFBCKKQHB-NSHDSACASA-N
| PubChem}}
| PubChem1_Comment = <small>(7a''R'')-7a-meth</small>
| StdInChI_Ref = {{stdinchicite|correct|chemspider}}
| StdInChI = 1S/C11H14O2/c1-10(2)5-4-6-11(3)8(10)7-9(12)13-11/h4,6-7H,5H2,1-3H3/t11-/m0/s1
| StdInChIKey_Ref = {{stdinchicite|correct|chemspider}}
| StdInChIKey = VGQSMHFBCKKQHB-NSHDSACASA-N
⚫ | PubChem = 11084442
| PubChem_Ref = {{Pubchemcite|correct| StdInChI_Ref = {{stdinchicite|correct|chemspider}}
| StdInChI = 1S/C11H14O2/c1-10(2)5-4-6-11(3)8(10)7-9(12)13-11/h4,6-7H,5H2,1-3H3/t11-/m0/s1
| StdInChIKey_Ref = {{stdinchicite|correct|chemspider}}
| StdInChIKey = VGQSMHFBCKKQHB-NSHDSACASA-N
| PubChem}}
| PubChem_Comment = <small>(7a''S'')-7a-meth</small>
| ChemSpiderID1 = 13078154
| ChemSpiderID1_Ref = {{chemspidercite|changed|chemspider}}
⚫ | ChemSpiderID = 10250059
⚫ | ChemSpiderID_Ref = {{chemspidercite|changed|chemspider}}
| ChemSpiderID_Comment = <small>(7a''S'')-7a-meth</small>
| SMILES = CC12OC(=O)C=C1C(C)(C)CC=C2
| SMILES1 = CC1(CC=CC2(C1=CC(=O)O2)C)C
| SMILES2 = O=C1C=C2C(C)(C)CC=CC2(C)O1
| InChI = 1/C11H14O2/c1-10(2)5-4-6-11(3)8(10)7-9(12)13-11/h4,6-7H,5H2,1-3H3
}}
| Section2 = {{Chembox Properties
| C = 11
| H = 14
| O = 2
| ExactMass = 178.099379692 g mol<sup>-1</sup>
}}
}} }}

Revision as of 20:05, 16 February 2012

This page contains a copy of the infobox ({{drugbox}}) taken from revid 474862755 of page Actinomycin with values updated to verified values.
Actinomycin D
Clinical data
Other names2-Amino- 4,6-dimethyl- 3-oxo- 3H-phenoxazine- 1,9-dicarboxylic acid bis-
MedlinePlusa682224
ATC code
Pharmacokinetic data
Protein binding5%
Elimination half-life36 hours
Identifiers
IUPAC name
  • 2-amino-N,N'- bis oxatetraazacyclohexadecin- 10-yl]- 4,6-dimethyl- 3-oxo- 3H-phenoxazine- 1,9-dicarboxamide
CAS Number
PubChem CID
ChemSpider
UNII
ChEBI
ChEMBL
NIAID ChemDB
Chemical and physical data
FormulaC62H86N12O16
Molar mass1255.42 g/mol g·mol
InChI
  • InChI=1S/C62H86N12O16/c1-27(2)42-59(84)73-23-17-19-36(73)57(82)69(13)25-38(75)71(15)48(29(5)6)61(86)88-33(11)44(55(80)65-42)67-53(78)35-22-21-31(9)51-46(35)64-47-40(41(63)50(77)32(10)52(47)90-51)54(79)68-45-34(12)89-62(87)49(30(7)8)72(16)39(76)26-70(14)58(83)37-20-18-24-74(37)60(85)43(28(3)4)66-56(45)81/h21-22,27-30,33-34,36-37,42-45,48-49H,17-20,23-26,63H2,1-16H3,(H,65,80)(H,66,81)(H,67,78)(H,68,79)/t33-,34-,36+,37+,42-,43-,44+,45+,48+,49+/m1/s1
  • Key:RJURFGZVJUQBHK-IIXSONLDSA-N
  (what is this?)  (verify)