Arohynapene b
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Formula: C18H22O3
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Molecular weight: 286.40
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Smiles: CC1CC(C2=C(C1)C=CC(=C2C=CC=CC(=O)O)CO)C
Arohynapene b
Names
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Mycotoxin name: Arohynapene b
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First synonym: Arohynapene b
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Synonyms: Arohynapene B,154445-09-7,(2E,4E)-5-[2-(hydroxymethyl)-6,8-dimethyl-5,6,7,8-tetrahydronaphthalen-1-yl]penta-2,4-dienoic acid,Arohynapene-B,BS-1554,5-(2-Hydroxymethyl-6,8-dimethyl-5,6,7,8-tetrahydronaphthalene)-2,4-pentadienoic acid,2,4-Pentadienoic acid, 5-(5,6,7,8-tetrahydro-2-(hydroxymethyl)-6,8-dimethyl-1-naphthalenyl)-
Identifiers / External links
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CAS: 154445-09-7
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PubChem CID: 6443712
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ChemSpiderID: 4947681
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Chemical Entities of Biological Interest (CHEBI): CHEBI:211554
Structure
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Smiles: CC1CC(C2=C(C1)C=CC(=C2C=CC=CC(=O)O)CO)C
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Isomeric smiles: CC1CC(C2=C(C1)C=CC(=C2/C=C/C=C/C(=O)O)CO)C
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Inchi: InChI=1S/C18H22O3/c1-12-9-13(2)18-14(10-12)7-8-15(11-19)16(18)5-3-4-6-17(20)21/h3-8,12-13,19H,9-11H2,1-2H3,(H,20,21)/b5-3+,6-4+
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Inchikey: XVNDJROXVPBPBY-GGWOSOGESA-N
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2D structure:
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3D structure:
Physico-chemical properties
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Formula: C18H22O3
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Molecular weight: 286.40
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Monoisotopic mass: 286.15689456
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Fungi
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Fungi id Species 945 Penicillium sp. FO-2295