Mollenine b
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Formula: C23H28N2O4
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Molecular weight: 396.50
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Smiles: CC(C)CC1C(=O)N2C(CC3(C2N(C4=CC=CC=C43)C=O)CC=C(C)C)C(=O)O1
Mollenine b
Names
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Mycotoxin name: Mollenine b
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First synonym: Mollenine b
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Synonyms: Mollenine B
Identifiers / External links
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CAS: 205692-57-5
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PubChem CID: 10786930
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ChemSpiderID: 8962243
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Chemical Entities of Biological Interest (CHEBI): CHEBI:204787
Structure
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Smiles: CC(C)CC1C(=O)N2C(CC3(C2N(C4=CC=CC=C43)C=O)CC=C(C)C)C(=O)O1
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Isomeric smiles: CC(C)C[C@@H]1C(=O)N2[C@H](C[C@@]3([C@H]2N(C4=CC=CC=C43)C=O)CC=C(C)C)C(=O)O1
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Inchi: InChI=1S/C23H28N2O4/c1-14(2)9-10-23-12-18-21(28)29-19(11-15(3)4)20(27)25(18)22(23)24(13-26)17-8-6-5-7-16(17)23/h5-9,13,15,18-19,22H,10-12H2,1-4H3/t18-,19-,22+,23+/m1/s1
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Inchikey: XHYHTGJZXZEXDW-VKGYTVAMSA-N
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2D structure:
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3D structure:
Physico-chemical properties
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Formula: C23H28N2O4
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Molecular weight: 396.50
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Monoisotopic mass: 396.20490738
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Fungi
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Fungi id Species 508 Eupenicillium molle