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The Drug-Drug Interactions Ontology
Last uploaded:
February 11, 2016
| Id | http://purl.obolibrary.org/obo/dinto_DB03574
http://purl.obolibrary.org/obo/dinto_DB03574
|
|---|---|
| Preferred Name | ferricrocin-iron |
| Synonyms |
(8R,14S,20R,23R)-14-(hydroxymethyl)-3,28,31-trimethyl-2$l^{3},29$l^{3},30$l^{3},36,37,40-hexaoxa-4,9,12,15,18,21,27,32,38-nonaaza-1-ferrahexacyclo[18.9.6.2^{8,23}.1^{1,4}.1^{1,27}.1^{1,32}]tetraconta-2,28,30-triene-10,13,16,19,22,39-hexone
C28H44FeN9O13
|
| Type | http://www.w3.org/2002/07/owl#Class |
All Properties
| prefLabel | ferricrocin-iron
|
|---|---|
| label | ferricrocin-iron
|
| type | |
| InChIKey | InChIKey=FNBCUYMSQPYITB-WESVPMFNSA-N
|
| Synonym | (8R,14S,20R,23R)-14-(hydroxymethyl)-3,28,31-trimethyl-2$l^{3},29$l^{3},30$l^{3},36,37,40-hexaoxa-4,9,12,15,18,21,27,32,38-nonaaza-1-ferrahexacyclo[18.9.6.2^{8,23}.1^{1,4}.1^{1,27}.1^{1,32}]tetraconta-2,28,30-triene-10,13,16,19,22,39-hexone
C28H44FeN9O13
|
| xref |
PDB:FCI
ChemSpider:140608
PubChem Substance:46506127
PubChem Compound:46936719
|
| prefixIRI | obo2:dinto_DB03574
|
| related with | |
| SMILES | CC1=[O][Fe]2345ON1CCC[C@H]1NC(=O)CNC(=O)[C@H](CO)NC(=O)CNC(=O)[C@@H](CCCN(O2)C(C)=[O]3)NC(=O)[C@@H](CCCN(O4)C(C)=[O]5)NC1=O
|
| InChI | InChI=1S/C28H44N9O13.Fe/c1-16(39)35(48)10-4-7-19-25(44)29-14-24(43)32-22(15-38)26(45)30-13-23(42)31-20(8-5-11-36(49)17(2)40)27(46)34-21(28(47)33-19)9-6-12-37(50)18(3)41;/h19-22,38H,4-15H2,1-3H3,(H,29,44)(H,30,45)(H,31,42)(H,32,43)(H,33,47)(H,34,46);/q-3;+3/t19-,20-,21-,22+;/m1./s1
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| subClassOf |
| Delete | Subject | Author | Type | Created |
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| No notes to display |