Pre-sclerotiotide F

AlkaPlorer ID: AK084998

Synonym: 'Pre-sclerotiotide F'

IUPAC Name: N-[(3S,6S,9S)-3,7-dimethyl-2,5,8-trioxo-6-propan-2-yl-1,4,7-triazacyclododec-9-yl]-6-oxohexa-2,4-dienamide

Structure

SMILES: CC(C)[C@H]1C(O)=N[C@@H](C)C(O)=NCCC[C@H](NC(=O)C=CC=CC=O)C(=O)N1C

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InChI: InChI=1S/C20H30N4O5/c1-13(2)17-19(28)22-14(3)18(27)21-11-8-9-15(20(29)24(17)4)23-16(26)10-6-5-7-12-25/h5-7,10,12-15,17H,8-9,11H2,1-4H3,(H,21,27)(H,22,28)(H,23,26)/t14-,15-,17-/m0/s1

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InChIKey: UITINDVBHJVYAN-ZOBUZTSGSA-N

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Source

Species Genus Family Order Class Phylum Kingdom Domain
Aspergillus insulicola Aspergillus Aspergillaceae Eurotiales Eurotiomycetes Ascomycota Fungi Eukaryota

Properties Information

Molecule Weight: 406.4830000000001

TPSA: 131.66

MolLogP: 1.360800000000001

Number of H-Donors: 3

Number of H-Acceptors: 5

RingCount: 1

Activities Information

Organism Target Name Standard Type Standard Value Standard Units doi

Metabolism Information