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loading...| Preferred Name |
Pangamic acid |
|
| Synonyms |
(2R,3S,4R,5R)-6-[2,2-bis[di(propan-2-yl)amino]acetyl]oxy-2,3,4,5-tetrahydroxyhexanoic acid |
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| ID |
http://purl.obolibrary.org/obo/CHEBI_172677 |
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| charge |
0 |
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| database_cross_reference |
CAS:13149-69-4 Chemspider:75049 |
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| formula |
C20H40N2O8 |
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| has_exact_synonym |
(2R,3S,4R,5R)-6-[2,2-bis[di(propan-2-yl)amino]acetyl]oxy-2,3,4,5-tetrahydroxyhexanoic acid |
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| has_obo_namespace |
chebi_ontology |
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| id |
CHEBI:172677 |
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| in_subset | ||
| inchi |
InChI=1S/C20H40N2O8/c1-10(2)21(11(3)4)18(22(12(5)6)13(7)8)20(29)30-9-14(23)15(24)16(25)17(26)19(27)28/h10-18,23-26H,9H2,1-8H3,(H,27,28)/t14-,15-,16+,17-/m1/s1 |
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| inchikey |
RVSTWRHIGKXTLG-WCXIOVBPSA-N |
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| label |
Pangamic acid |
|
| mass |
436.546 |
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| monoisotopicmass |
436.27847 |
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| notation |
CHEBI:172677 |
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| prefLabel |
Pangamic acid |
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| smiles |
O(C(=O)C(N(C(C)C)C(C)C)N(C(C)C)C(C)C)C[C@@H](O)[C@@H](O)[C@H](O)[C@@H](O)C(O)=O |
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| subClassOf |
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