loading...| Preferred Name | O-(chloroacetylcarbamoyl)fumagillol | |
| Synonyms |
Agm 1470 TNP-470 (CHLOROACETYL)CARBAMIC ACID (3R,4S,5S,5R)-5-METHOXY-4-[(2R,3R)-2-METHYL-3-(3-METHYL-2-BUTENYL)OXIRANYL]-1-OXASPIRO[2.5]OCT-6-YL ESTER TNP 470 O-chloroacetylcarbamoylfumagillol DRG-0148 AGM-1470 (3R,4S,5S,6R)-5-methoxy-4-[(2R,3R)-2-methyl-3-(3-methylbut-2-en-1-yl)oxiran-2-yl]-1-oxaspiro[2.5]octan-6-yl (chloroacetyl)carbamate |
|
| Definitions |
A carbamate ester that is fumagillol in which the hydroxy group has been converted to the corresponding N-(chloroacetyl)carbamate derivative. |
|
| ID |
http://purl.obolibrary.org/obo/CHEBI_90748 |
|
| charge |
0 |
|
| database_cross_reference |
PMID:12114444 PMID:8806471 PMID:25652463 PMID:26254366 PMID:26369821 CAS:129298-91-5 PMID:9876375 DrugBank:DB08633 PMID:8616900 Reaxys:5358869 PMID:15736572 PMID:11291554 LINCS:LSM-37119 PMID:22510957 PMID:9059342 PDBeChem:TN4 |
|
| definition |
A carbamate ester that is fumagillol in which the hydroxy group has been converted to the corresponding N-(chloroacetyl)carbamate derivative. |
|
| formula |
C19H28ClNO6 |
|
| has functional parent | ||
| has role |
http://purl.obolibrary.org/obo/CHEBI_35610 http://purl.obolibrary.org/obo/CHEBI_50683 http://purl.obolibrary.org/obo/CHEBI_90713 |
|
| has_alternative_id |
CHEBI:47708 |
|
| has_exact_synonym |
(3R,4S,5S,6R)-5-methoxy-4-[(2R,3R)-2-methyl-3-(3-methylbut-2-en-1-yl)oxiran-2-yl]-1-oxaspiro[2.5]octan-6-yl (chloroacetyl)carbamate |
|
| has_obo_namespace |
chebi_ontology |
|
| has_related_synonym |
Agm 1470 TNP-470 (CHLOROACETYL)CARBAMIC ACID (3R,4S,5S,5R)-5-METHOXY-4-[(2R,3R)-2-METHYL-3-(3-METHYL-2-BUTENYL)OXIRANYL]-1-OXASPIRO[2.5]OCT-6-YL ESTER TNP 470 O-chloroacetylcarbamoylfumagillol DRG-0148 AGM-1470 |
|
| id |
CHEBI:90748 |
|
| in_subset | ||
| inchi |
InChI=1S/C19H28ClNO6/c1-11(2)5-6-13-18(3,27-13)16-15(24-4)12(7-8-19(16)10-25-19)26-17(23)21-14(22)9-20/h5,12-13,15-16H,6-10H2,1-4H3,(H,21,22,23)/t12-,13-,15-,16-,18+,19+/m1/s1 |
|
| inchikey |
MSHZHSPISPJWHW-PVDLLORBSA-N |
|
| label |
O-(chloroacetylcarbamoyl)fumagillol |
|
| mass |
401.882 |
|
| monoisotopicmass |
401.16052 |
|
| notation |
CHEBI:90748 |
|
| prefLabel |
O-(chloroacetylcarbamoyl)fumagillol |
|
| smiles |
[C@]1([C@]2(O[C@@]2(CC=C(C)C)[H])C)([H])[C@H](OC)[C@@H](CC[C@]13CO3)OC(=O)NC(=O)CCl |
|
| treeView |
http://purl.obolibrary.org/obo/CHEBI_133131 http://purl.obolibrary.org/obo/CHEBI_72588 http://purl.obolibrary.org/obo/CHEBI_36683 |
|
| subClassOf |
http://purl.obolibrary.org/obo/CHEBI_133131 http://purl.obolibrary.org/obo/CHEBI_72588 http://purl.obolibrary.org/obo/CHEBI_36683 |