Molecule

Cyclotine

AlkaPlorer ID: AK103481

Synonym: None

IUPAC Name: (3S,7R,10S,13S,16S)-13-ethyl-3,10-bis(hydroxymethyl)-7-phenyl-1,4,8,11,14-pentazabicyclo[14.3.0]nonadecane-2,5,9,12,15-pentone

Structure

SMILES: CC[C@@H]1N=C(O)[C@@H]2CCCN2C(=O)[C@H](CO)N=C(O)C[C@H](C2=CC=CC=C2)N=C(O)[C@H](CO)N=C1O

InChI: InChI=1S/C24H33N5O7/c1-2-15-21(33)28-17(12-30)22(34)27-16(14-7-4-3-5-8-14)11-20(32)25-18(13-31)24(36)29-10-6-9-19(29)23(35)26-15/h3-5,7-8,15-19,30-31H,2,6,9-13H2,1H3,(H,25,32)(H,26,35)(H,27,34)(H,28,33)/t15-,16+,17-,18-,19-/m0/s1

InChIKey: JAPQCCQLPMCXRC-PJVZLEMVSA-N

Reference

The cyclochlorotine mycotoxin is produced by the nonribosomal peptide synthetase CctN in <i>Talaromyces islandicus</i> (‘<i>Penicillium islandicum</i>’)

PubChem CID: 145720576

LOTUS: LTS0247550

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NPAtlas: NPA024675

Source

Species	Genus	Family	Order	Class	Phylum	Kingdom	Domain
Talaromyces islandicus	Talaromyces	Trichocomaceae	Eurotiales	Eurotiomycetes	Ascomycota	Fungi	Eukaryota

Properties Information

Molecule Weight: 503.55600000000015

TPSA？: 191.13

MolLogP？: 1.4487999999999996

Number of H-Donors: 6

Number of H-Acceptors: 7

RingCount: 3

Activities Information

Organism	Target Name	Standard Type	Standard Value	Standard Units	doi