Acremolide d
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Formula: C24H42N2O6
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Molecular weight: 454.60
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Smiles: CC1C(CC(OC(=O)C2CCCN2C(=O)C(NC1=O)C(C)C)C(C)CCCCC(C)O)O
Acremolide d
Names
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Mycotoxin name: Acremolide d
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First synonym: Acremolide d
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Synonyms: ACREMOLIDE D,CHEMBL401602
Identifiers / External links
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CAS: 1015236-25-5
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PubChem CID: 24853813
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ChemSpiderID: 27023311
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ChEMBL: CHEMBL401602
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Chemical Entities of Biological Interest (CHEBI): CHEBI:207483
Structure
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Smiles: CC1C(CC(OC(=O)C2CCCN2C(=O)C(NC1=O)C(C)C)C(C)CCCCC(C)O)O
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Isomeric smiles: CC1C(CC(OC(=O)[C@@H]2CCCN2C(=O)[C@H](NC1=O)C(C)C)C(C)CCCCC(C)O)O
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Inchi: InChI=1S/C24H42N2O6/c1-14(2)21-23(30)26-12-8-11-18(26)24(31)32-20(13-19(28)17(5)22(29)25-21)15(3)9-6-7-10-16(4)27/h14-21,27-28H,6-13H2,1-5H3,(H,25,29)/t15?,16?,17?,18-,19?,20?,21+/m0/s1
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Inchikey: JKARYSQDCYPQGG-AGASRBRESA-N
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2D structure:
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3D structure:
Physico-chemical properties
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Formula: C24H42N2O6
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Molecular weight: 454.60
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Monoisotopic mass: 454.30428706
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Fungi
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Fungi id Species 21 Acremonium sp. MST-MF588a