12-Oxa-2,6,10-triazatetradecanoic acid, 4,8-dihydroxy-13,13-dimethyl-3-((4-(3-(4-morpholinyl)-3-oxopropyl)phenyl)methyl)-11-oxo-9-(phenylmethyl)-, 1,1-dimethylethyl ester, (3S-(3R*,4S*,8S*,9R*))

Modify Date: 2026-04-28 17:49:56

12-Oxa-2,6,10-triazatetradecanoic acid, 4,8-dihydroxy-13,13-dimethyl-3-((4-(3-(4-morpholinyl)-3-oxopropyl)phenyl)methyl)-11-oxo-9-(phenylmethyl)-, 1,1-dimethylethyl ester, (3S-(3R*,4S*,8S*,9R*)) Structure
12-Oxa-2,6,10-triazatetradecanoic acid, 4,8-dihydroxy-13,13-dimethyl-3-((4-(3-(4-morpholinyl)-3-oxopropyl)phenyl)methyl)-11-oxo-9-(phenylmethyl)-, 1,1-dimethylethyl ester, (3S-(3R*,4S*,8S*,9R*)) structure
Common Name 12-Oxa-2,6,10-triazatetradecanoic acid, 4,8-dihydroxy-13,13-dimethyl-3-((4-(3-(4-morpholinyl)-3-oxopropyl)phenyl)methyl)-11-oxo-9-(phenylmethyl)-, 1,1-dimethylethyl ester, (3S-(3R*,4S*,8S*,9R*))
CAS Number 175233-60-0 Molecular Weight 684.9
Density N/A Boiling Point N/A
Molecular Formula C37H56N4O8 Melting Point N/A
MSDS N/A Flash Point N/A

 Names

Name 12-Oxa-2,6,10-triazatetradecanoic acid, 4,8-dihydroxy-13,13-dimethyl-3-((4-(3-(4-morpholinyl)-3-oxopropyl)phenyl)methyl)-11-oxo-9-(phenylmethyl)-, 1,1-dimethylethyl ester, (3S-(3R*,4S*,8S*,9R*))

 Chemical & Physical Properties

Molecular Formula C37H56N4O8
Molecular Weight 684.9
InChIKey SGSVELRCCSUWEU-GASGPIRDSA-N
SMILES CC(C)(C)OC(=O)N[C@@H](CC1=CC=CC=C1)[C@@H](CNC[C@H]([C@H](CC2=CC=C(C=C2)CCC(=O)N3CCOCC3)NC(=O)OC(C)(C)C)O)O

 Bioassay

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Name: Inhibitory activity against human T cell lymphoma (H9) growth by 50 %.
Source: ChEMBL
Target: H9
External Id: CHEMBL683845
Name: Lipophilicity index (RP-HPLC pH 7)
Source: ChEMBL
Target: N/A
External Id: CHEMBL636297
Name: Inhibitory activity against HIV-1 virus replication as determined by an XTT endpoint ...
Source: ChEMBL
Target: CEM-SS
External Id: CHEMBL656454
Name: Protease Inhibition Assay from Article 10.1021/jm950717a: "Aminodiol HIV protease inh...
Source: BindingDB
Target: N/A
External Id: BindingDB_331_1
Name: Inhibitory activity against HIV-1 protease cleavage of [V-S-Q-N-(beta-naphthylalanine...
Source: ChEMBL
Target: Pol polyprotein
External Id: CHEMBL760098
Name: HIV Enzyme Data
Source: NIAID
Target: N/A
External Id: HIV Enzyme Data
Name: HIV Cellular Data
Source: NIAID
Target: N/A
External Id: HIV Cellular Data
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