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Ergostine

HCID 160657
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Basic information

CAS
2854-38-8
Standard SMILES
CC[C@@]1(NC(=O)[C@@H]2C=C3c4cccc5[nH]cc(c45)C[C@H]3N(C)C2)O[C@@]2(O)[C@@H]3CCCN3C(=O)[C@@H](Cc3ccccc3)N2C1=O
InChIKey
BOLCFGMGGWCOOE-UQNXEMKDSA-N
Molecular formula
C34H37N5O5
Average molar mass
595.7 g/mol
Monoisotopic mass
595.27946928

Names & identifiers

Preferred name
Ergostine
IUPAC
5'beta-Benzyl-2'-ethyl-12'-hydroxy-3',6',18-trioxo-5alpha,8alpha-ergotaman

Database identifiers

CAS
2854-38-8
PubChem CID
160657
DTXSID
DTXSID10951231

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