loading...| Preferred Name |
alpha-Chaconine |
| Synonyms |
alpha-Chaconine |
| ID |
http://purl.obolibrary.org/obo/CHEBI_10219 |
| charge |
0 |
| database_cross_reference |
KEGG:C10796 KNApSAcK:C00002242 CAS:20562-03-2 |
| formula |
C45H73NO14 |
| has_exact_synonym |
alpha-Chaconine |
| has_obo_namespace |
chebi_ontology |
| id |
CHEBI:10219 |
| in_subset | |
| inchi |
InChI=1S/C45H73NO14/c1-19-7-10-28-20(2)31-29(46(28)17-19)16-27-25-9-8-23-15-24(11-13-44(23,5)26(25)12-14-45(27,31)6)57-43-40(60-42-37(53)35(51)33(49)22(4)56-42)38(54)39(30(18-47)58-43)59-41-36(52)34(50)32(48)21(3)55-41/h8,19-22,24-43,47-54H,7,9-18H2,1-6H3/t19-,20+,21-,22-,24-,25+,26-,27-,28+,29-,30+,31-,32-,33-,34+,35+,36+,37+,38-,39+,40+,41-,42-,43+,44-,45-/m0/s1 |
| inchikey |
TYNQWWGVEGFKRU-AJDPQWBVSA-N |
| label |
alpha-Chaconine |
| mass |
852.061 |
| monoisotopicmass |
851.50311 |
| notation |
CHEBI:10219 |
| prefLabel |
alpha-Chaconine |
| smiles |
C[C@@H]1[C@H]2CC[C@H](C)CN2[C@H]2C[C@H]3[C@@H]4CC=C5C[C@H](CC[C@]5(C)[C@H]4CC[C@]3(C)[C@@H]12)O[C@@H]1O[C@H](CO)[C@@H](O[C@@H]2O[C@@H](C)[C@H](O)[C@@H](O)[C@H]2O)[C@H](O)[C@H]1O[C@@H]1O[C@@H](C)[C@H](O)[C@@H](O)[C@H]1O |
| treeView | |
| subClassOf |
| Delete | Mapping To | Ontology | Source |
|---|---|---|---|
| http://purl.bioontology.org/ontology/MESH/C011860 | Medical Subject Headings / 医学主题词表 | LOOM |