EMBL-EBI | Chemical Biology | ChEBI
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| Formula | C27H37NO2 |
| Net Charge | 0 |
| Average Mass | 407.598 |
| Monoisotopic Mass | 407.28243 |
| SMILES | CCC/C=C/CC1C/C=C/C=C(C)/C=C/C=C\C(O)C/C=C(C)/C=C/C=C/C(=O)N1 |
| InChI | InChI=1S/C27H37NO2/c1-4-5-6-7-17-25-18-11-8-14-23(2)15-9-12-19-26(29)22-21-24(3)16-10-13-20-27(30)28-25/h6-16,19-21,25-26,29H,4-5,17-18,22H2,1-3H3,(H,28,30)/b7-6+,11-8+,15-9+,16-10+,19-12-,20-13+,23-14+,24-21+ |
| InChIKey | UMYFIUGQWGBKLX-MMJNJZBSSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| GT32-B (CHEBI:212935) is a azamacrocycle (CHEBI:52898) |
| GT32-B (CHEBI:212935) is a keratan 6'-sulfate (CHEBI:18331) |
| IUPAC Name |
|---|
| (3E,5E,7E,11Z,13E,15E,17E)-20-[(E)-hex-2-enyl]-10-hydroxy-7,15-dimethyl-1-azacycloicosa-3,5,7,11,13,15,17-heptaen-2-one |
| Manual Xrefs | Databases |
|---|---|
| 8584576 | ChemSpider |