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Chemical structure of Fusarisetin A

GC43719

Fusarisetin A

Also known as (1S,2S,3S,5R,6S,9R,11S,12R,15R,17S)-5-hydroxy-6-(hydroxymethyl)-3,7,11,15-tetramethyl-4-oxa-7-azapentacyclo[9.8.0.02,9.05,9.012,17]nonadec-18-ene-8,10-dione

Fusarisetin A is a pentacyclic fungal metabolite first isolated from Fusarium species

ChemicalCAS1300041-53-5MW389.5FormulaC22H31NO5
CAS number
1300041-53-5
Molecular weight
389.5
Formula
C22H31NO5
Solubility
Soluble in DMSO
InChIKey
IIZSEOKGOHTBLK-KDLRZXEZSA-N
Catalogue number
GC43719
Brand
GLPBIO
Computed properties PubChem CID 117797928 · XLogP 2.1 · TPSA 87.1 Ų · H-bond donors 2
XLogP
2.1
TPSA
87.1 Ų
H-bond donors
2
H-bond acceptors
5
Rotatable bonds
1
Heavy atoms
28

SMILES C[C@@H]1CC[C@@H]2[C@@H](C1)C=C[C@@H]3[C@]2(C(=O)[C@]45[C@H]3[C@@H](O[C@]4([C@@H](N(C5=O)C)CO)O)C)C

Computed descriptors from PubChem (CID 117797928), public domain. Identity cross-checked against the supplier's molecular formula and weight — verify before use.

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