Sta 2
(Z)-7-[(1S,2R,3R,5S)-3-[(E,3R)-3-hydroxyoct-1-enyl]-6-thiabicyclo[3.1.1]heptan-2-yl]hept-5-enoic acid
Molecular Identity
Sta 2
(Z)-7-[(1S,2R,3R,5S)-3-[(E,3R)-3-hydroxyoct-1-enyl]-6-thiabicyclo[3.1.1]heptan-2-yl]hept-5-enoic acid
PubChem CID: 5311453
2D Structure
Properties
C21H34O3S
Molecular Formula
366.60
Molecular Weight
g/mol
366.2229
Exact Mass
Da
4.9
XLogP
Drug-like (Lipinski: < 5)
82.8
TPSA
Good oral absorption (< 140 A²)
2
H-Bond Donors
4
H-Bond Acceptors
460
Complexity
SMILES
Canonical SMILES
SMILES: CCCCCC(C=CC1CC2CC(C1CC=CCCCC(=O)O)S2)OIsomeric SMILES
SMILES: CCCCC[C@H](/C=C/[C@H]1C[C@H]2C[C@@H]([C@@H]1C/C=C\CCCC(=O)O)S2)OSynonyms(16)
STA2STA 2STxA2STA-280408-46-4ONO-11113(Z)-7-((1S,2R,3R,5S)-3-((E,3R)-3-hydroxyoct-1-enyl)-7-thiabicyclo(3.1.1)heptan-2-yl)hept-5-enoic acid(Z)-7-[(1S,2R,3R,5S)-3-[(E,3R)-3-hydroxyoct-1-enyl]-7-thiabicyclo[3.1.1]heptan-2-yl]hept-5-enoic acid9,11-Epithio-11,12-methanothromboxane A2RefChem:9321635-Heptenoic acid, 7-(3-(3-hydroxy-1-octenyl)-6-thiabicyclo(3.1.1)hept-2-yl)-, (1alpha,2beta(Z),3alpha(1E,3R*),5alpha)-9,11-Epithio-11,12-methano-TXA211alpha-carba-9alpha,11beta-thia-Txa2GTPL1939Q27088883
Data from PubChem (NCBI)
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Drug Network
Trials and conditions connected to Sta 2
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