Kos-1584
(4S,7R,8S,9S,10E,13Z,16S)-4,8-dihydroxy-5,5,7,9,13-pentamethyl-16-[(E)-1-(2-methyl-1,3-thiazol-4-yl)prop-1-en-2-yl]-1-oxacyclohexadeca-10,13-diene-2,6-dione
Molecular Identity
Kos-1584
(4S,7R,8S,9S,10E,13Z,16S)-4,8-dihydroxy-5,5,7,9,13-pentamethyl-16-[(E)-1-(2-methyl-1,3-thiazol-4-yl)prop-1-en-2-yl]-1-oxacyclohexadeca-10,13-diene-2,6-dione
PubChem CID: 6918835
2D Structure
Properties
C27H39NO5S
Molecular Formula
489.70
Molecular Weight
g/mol
489.2549
Exact Mass
Da
4.7
XLogP
Drug-like (Lipinski: < 5)
125
TPSA
Good oral absorption (< 140 A²)
2
H-Bond Donors
7
H-Bond Acceptors
818
Complexity
SMILES
Canonical SMILES
SMILES: CC1C=CCC(=CCC(OC(=O)CC(C(C(=O)C(C1O)C)(C)C)O)C(=CC2=CSC(=N2)C)C)CIsomeric SMILES
SMILES: C[C@H]1/C=C/C/C(=C\C[C@H](OC(=O)C[C@@H](C(C(=O)[C@@H]([C@H]1O)C)(C)C)O)/C(=C/C2=CSC(=N2)C)/C)/CSynonyms(20)
KOS-1584Dehydelone(E)-9,10-Didehydroepothilone D(E)-9,10-Dehydroepothilone D350493-61-7R-1645R16459,10-TRANS-DEHYDROEPOTHILONE D82481G197K(4S,7R,8S,9S,10E,13Z,16S)-4,8-Dihydroxy-5,5,7,9,13-pentamethyl-16-((E)-1-methyl-2-(2-methyl-1,3-thiazol-4-yl)vinyl)oxacyclohexadeca-10,13-diene-2,6-dioneDTXSID00870184(4S,7R,8S,9S,10E,13Z,16S)-4,8-dihydroxy-5,5,7,9,13-pentamethyl-16-((1E)-1-(2-methyl-1,3-thiazol-4-yl)prop-1-en-2-yl)-1-oxacyclohexadeca-10,13-diene-2,6-dione(4S,7R,8S,9S,10E,13Z,16S)-4,8-dihydroxy-5,5,7,9,13-pentamethyl-16-[(1E)-1-(2-methyl-1,3-thiazol-4-yl)prop-1-en-2-yl]-1-oxacyclohexadeca-10,13-diene-2,6-dioneEpothilone KOS-1584RefChem:151431
Data from PubChem (NCBI)
This platform is for informational purposes only and does not constitute medical advice. Always consult a qualified healthcare professional.
Drug Network
Trials and conditions connected to Kos-1584
Loading drug network...