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Roquefortine F

AlkaPlorer ID: AK084325

Synonym: 'roquefortine F'

IUPAC Name: (1R,7S,9R)-4-(1H-imidazol-5-ylmethylidene)-16-methoxy-9-(2-methylbut-3-en-2-yl)-2,5,16-triazatetracyclo[7.7.0.02,7.010,15]hexadeca-10,12,14-triene-3,6-dione

Structure

SMILES: C=CC(C)(C)[C@@]12C[C@H]3C(=O)NC(=CC4=CNC=N4)C(=O)N3[C@@H]1N(OC)C1=CC=CC=C12

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InChI: InChI=1S/C23H25N5O3/c1-5-22(2,3)23-11-18-19(29)26-16(10-14-12-24-13-25-14)20(30)27(18)21(23)28(31-4)17-9-7-6-8-15(17)23/h5-10,12-13,18,21H,1,11H2,2-4H3,(H,24,25)(H,26,29)/t18-,21+,23+/m0/s1

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InChIKey: UGXLTDJSORIITQ-QTGUNEKASA-N

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Reference

PubChem CID: 162983430

NPASS: NPC23925

Source

Species Genus Family Order Class Phylum Kingdom Domain
Otostegia fruticosa Otostegia Lamiaceae Lamiales Magnoliopsida Streptophyta Viridiplantae Eukaryota
Cinnamosma madagascariensis Cinnamosma Canellaceae Canellales Magnoliopsida Streptophyta Viridiplantae Eukaryota
Lepista irina Lepista Clitocybaceae Agaricales Agaricomycetes Basidiomycota Fungi Eukaryota
Streptomyces caelestis Streptomyces Streptomycetaceae Kitasatosporales Actinomycetes Actinomycetota None Bacteria
Saccharothrix mutabilis Saccharothrix Pseudonocardiaceae Pseudonocardiales Actinomycetes Actinomycetota None Bacteria
Artemisia taurica Artemisia Asteraceae Asterales Magnoliopsida Streptophyta Viridiplantae Eukaryota
Trichoderma citrinum Trichoderma Hypocreaceae Hypocreales Sordariomycetes Ascomycota Fungi Eukaryota
Periploca forrestii Periploca Apocynaceae Gentianales Magnoliopsida Streptophyta Viridiplantae Eukaryota
Paranephelius uniflorus Paranephelius Asteraceae Asterales Magnoliopsida Streptophyta Viridiplantae Eukaryota
Bruguiera gymnorhiza Bruguiera Rhizophoraceae Malpighiales Magnoliopsida Streptophyta Viridiplantae Eukaryota
Helichrysum nudifolium Helichrysum Asteraceae Asterales Magnoliopsida Streptophyta Viridiplantae Eukaryota
Streptomyces atratus Streptomyces Streptomycetaceae Kitasatosporales Actinomycetes Actinomycetota None Bacteria
Ceramium botryocarpum Ceramium Ceramiaceae Ceramiales Florideophyceae Rhodophyta None Eukaryota
Daldinia concentrica Daldinia Hypoxylaceae Xylariales Sordariomycetes Ascomycota Fungi Eukaryota
Pseudomonas chlororaphis Pseudomonas Pseudomonadaceae Pseudomonadales Gammaproteobacteria Pseudomonadota None Bacteria
Agaricus silvaticus Agaricus Agaricaceae Agaricales Agaricomycetes Basidiomycota Fungi Eukaryota
Sonneratia alba Sonneratia Lythraceae Myrtales Magnoliopsida Streptophyta Viridiplantae Eukaryota
Pardachirus pavoninus Pardachirus Soleidae Pleuronectiformes Actinopteri Chordata Metazoa Eukaryota
Tephroseris integrifolia Tephroseris Asteraceae Asterales Magnoliopsida Streptophyta Viridiplantae Eukaryota
Umbilicaria cinereorufescens Umbilicaria Umbilicariaceae Umbilicariales Lecanoromycetes Ascomycota Fungi Eukaryota
Ulva prolifera Ulva Ulvaceae Ulvales Ulvophyceae Chlorophyta Viridiplantae Eukaryota
Rhododendron aureum Rhododendron Ericaceae Ericales Magnoliopsida Streptophyta Viridiplantae Eukaryota
Mirabilis jalapa Mirabilis Nyctaginaceae Caryophyllales Magnoliopsida Streptophyta Viridiplantae Eukaryota
Aegiceras corniculatum Aegiceras Primulaceae Ericales Magnoliopsida Streptophyta Viridiplantae Eukaryota
Isoberlinia angolensis Isoberlinia Fabaceae Fabales Magnoliopsida Streptophyta Viridiplantae Eukaryota
Hypoxis nyasica Hypoxis Hypoxidaceae Asparagales Magnoliopsida Streptophyta Viridiplantae Eukaryota
Arbutus menziesii Arbutus Ericaceae Ericales Magnoliopsida Streptophyta Viridiplantae Eukaryota
Ajuga bracteosa Ajuga Lamiaceae Lamiales Magnoliopsida Streptophyta Viridiplantae Eukaryota
Stichopus horrens Stichopus Stichopodidae Aspidochirotida Holothuroidea Echinodermata Metazoa Eukaryota
Echiochilon pauciflorum Echiochilon Boraginaceae Boraginales Magnoliopsida Streptophyta Viridiplantae Eukaryota
Sophora viciifolia Sophora Fabaceae Fabales Magnoliopsida Streptophyta Viridiplantae Eukaryota
Sipunculus nudus Sipunculus Sipunculidae Golfingiida Sipuncula Annelida Metazoa Eukaryota
Teucrium orientale Teucrium Lamiaceae Lamiales Magnoliopsida Streptophyta Viridiplantae Eukaryota
Xylopia aethiopica Xylopia Annonaceae Magnoliales Magnoliopsida Streptophyta Viridiplantae Eukaryota

Properties Information

Molecule Weight: 419.4850000000002

TPSA？: 90.56

MolLogP？: 2.3390000000000004

Number of H-Donors: 2

Number of H-Acceptors: 5

RingCount: 5

Activities Information

Organism Target Name Standard Type Standard Value Standard Units doi

Metabolism Information