chaetomugilin k
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Formula: C23H29ClO5
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Molecular weight: 420.90
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Smiles: CC=C(C)C1(CC2C3=COC(=CC3=C(C(=O)C2(O1)C)Cl)C=CC(C)C(C)O)OC
chaetomugilin k
Names
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Mycotoxin name: chaetomugilin k
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First synonym: None
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Synonyms: Chaetomugilin K,CHEBI:207658,(6aS,8S,9aS)-8-[(E)-but-2-en-2-yl]-5-chloro-3-[(E,3R,4R)-4-hydroxy-3-methylpent-1-enyl]-8-methoxy-6a-methyl-9,9a-dihydrouro[2,3-h]isochromen-6-one,1187848-03-8
Identifiers / External links
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CAS: 1187848-03-8
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PubChem CID: 44250066
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ChemSpiderID: 27024230
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Chemical Entities of Biological Interest (CHEBI): CHEBI:207658
Structure
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Smiles: CC=C(C)C1(CC2C3=COC(=CC3=C(C(=O)C2(O1)C)Cl)C=CC(C)C(C)O)OC
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Isomeric smiles: C/C=C(\C)/[C@@]1(C[C@H]2C3=COC(=CC3=C(C(=O)[C@]2(O1)C)Cl)/C=C/[C@@H](C)[C@@H](C)O)OC
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Inchi: InChI=1S/C23H29ClO5/c1-7-14(3)23(27-6)11-19-18-12-28-16(9-8-13(2)15(4)25)10-17(18)20(24)21(26)22(19,5)29-23/h7-10,12-13,15,19,25H,11H2,1-6H3/b9-8+,14-7+/t13-,15-,19+,22+,23+/m1/s1
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Inchikey: MNARQGUPBCVGOV-SXSABYTNSA-N
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2D structure:
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3D structure:
Physico-chemical properties
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Formula: C23H29ClO5
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Molecular weight: 420.90
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Monoisotopic mass: 420.1703517
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Fungi
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Fungi id Species 338 Chaetomium globosum OUPS-T106B-6