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Basic information
- CAS
561-94-4- Standard SMILES
CC(C)C[C@H]1C(=O)N2CCC[C@H]2[C@]2(O)O[C@@](C)(NC(=O)[C@@H]3C=C4c5cccc6[nH]cc(c56)C[C@H]4N(C)C3)C(=O)N12- InChIKey
NESVMZOPWPCFAU-ZPRCMDFASA-N- Molecular formula
- C30H37N5O5
- Average molar mass
- 547.656 g/mol
- Monoisotopic mass
- 547.27946928
Names & identifiers
- Preferred name
- Ergosine
- IUPAC
- 12'-Hydroxy-2'-methyl-5'alpha-(2-methylpropyl)-3',6',18-trioxoergotaman
Database identifiers
- CAS
561-94-4- PubChem CID
- 105137
- DTXSID
DTXSID50893989- ChEBI
CHEBI:4823- UNII
- 6WF908487H
- EC Number
- 209-226-6
- Nikkaji
- J33.904K
Related reactions
3 records
Compound notes
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