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Chemical structure of Ikarugamycin

GC43892

Ikarugamycin

Also known as (1Z,3E,5S,7R,8R,10R,11R,12S,15R,16S,18Z,25S)-11-ethyl-2-hydroxy-10-methyl-21,26-diazapentacyclo[23.2.1.05,16.07,15.08,12]octacosa-1,3,13,18-tetraene-20,27,28-trione

Ikarugamycin is a macrocyclic antibiotic first isolated from Streptomyces sp

ChemicalCAS36531-78-9MW478.6FormulaC29H38N2O4
CAS number
36531-78-9
Molecular weight
478.6
Formula
C29H38N2O4
Solubility
Soluble in DMSO，DMF, slightly in ethanol, methanol
InChIKey
GHXZHWYUSAWISC-KZRBWAKNSA-N
Catalogue number
GC43892
Brand
GLPBIO
Computed properties PubChem CID 54680304 · XLogP 5 · TPSA 95.5 Ų · H-bond donors 3
XLogP
5
TPSA
95.5 Ų
H-bond donors
3
H-bond acceptors
4
Rotatable bonds
1
Heavy atoms
35

SMILES CC[C@@H]1[C@@H](C[C@H]2[C@H]1C=C[C@H]3[C@@H]2C[C@@H]/4[C@@H]3C/C=C\C(=O)NCCC[C@H]5C(=O)/C(=C(\C=C4)/O)/C(=O)N5)C

Computed descriptors from PubChem (CID 54680304), public domain. Identity cross-checked against the supplier's molecular formula and weight — verify before use.

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