cob(II)yrinate c-monoamide (PAMDB120465)
Record Information | |||||
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Version | 1.0 | ||||
Update Date | 1/22/2018 11:54:54 AM | ||||
Metabolite ID | PAMDB120465 | ||||
Identification | |||||
Name: | cob(II)yrinate c-monoamide | ||||
Description: | Not Available | ||||
Structure | |||||
Synonyms: |
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Chemical Formula: | C45H54N5O13CO | ||||
Average Molecular Weight: | 931.877 | ||||
Monoisotopic Molecular Weight: | 937.352 | ||||
InChI Key: | RZFKRMUXXDOOID-OKJGWHJPSA-G | ||||
InChI: | InChI=1S/C45H61N5O13.Co/c1-21-36-24(10-13-31(54)55)41(3,4)28(48-36)18-27-23(9-12-30(52)53)43(6,19-29(46)51)39(47-27)22(2)37-25(11-14-32(56)57)44(7,20-35(62)63)45(8,50-37)40-26(17-34(60)61)42(5,38(21)49-40)16-15-33(58)59;/h18,23-26,40H,9-17,19-20H2,1-8H3,(H9,46,47,48,49,50,51,52,53,54,55,56,57,58,59,60,61,62,63);/q;+6/p-7/t23-,24-,25-,26+,40-,42-,43+,44+,45+;/m1./s1 | ||||
CAS number: | Not Available | ||||
IUPAC Name: | Not Available | ||||
Traditional IUPAC Name: | Not Available | ||||
SMILES: | CC2(C1(C(CCC([O-])=O)C(C)(C)C6([N+]=1[Co++]58(N3([CH](C(C(CCC([O-])=O)(C)C=23)CC([O-])=O)C4(C)(C(C)(CC([O-])=O)C(CCC(=O)[O-])C(=[N+]45)C(=C7([N+](=C(C=6)C(C(C)(CC(N)=O)7)CCC([O-])=O)8))C)))))) | ||||
Chemical Taxonomy | |||||
Taxonomy Description | This compound belongs to the class of organic compounds known as metallotetrapyrroles. These are polycyclic compounds containing a tetrapyrrole skeleton combined with a metal atom. | ||||
Kingdom | Organic compounds | ||||
Super Class | Organoheterocyclic compounds | ||||
Class | Tetrapyrroles and derivatives | ||||
Sub Class | Metallotetrapyrroles | ||||
Direct Parent | Metallotetrapyrroles | ||||
Alternative Parents |
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Substituents |
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Molecular Framework | Aliphatic heteropolycyclic compounds | ||||
External Descriptors | Not Available | ||||
Physical Properties | |||||
State: | Not Available | ||||
Charge: | Not Available | ||||
Melting point: | Not Available | ||||
Experimental Properties: | Not Available | ||||
Predicted Properties | Not Available | ||||
Biological Properties | |||||
Cellular Locations: | Not Available | ||||
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Pathways: |
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Spectra | |||||
Spectra: | Not Available | ||||
References | |||||
References: | Not Available | ||||
Synthesis Reference: | Not Available | ||||
Material Safety Data Sheet (MSDS) | Not Available | ||||
Links | |||||
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