TMC-52D
AlkaPlorer ID: AK074555
Synonym: None
IUPAC Name: 3-[[(2S)-1-[4-(3-aminopropylamino)butylamino]-1-oxo-3-phenylpropan-2-yl]carbamoyl]oxirane-2-carboxylic acid
Structure
SMILES: NCCCNCCCCN=C(O)[C@H](CC1=CC=CC=C1)N=C(O)C1OC1C(=O)O
InChI: InChI=1S/C20H30N4O5/c21-9-6-11-22-10-4-5-12-23-18(25)15(13-14-7-2-1-3-8-14)24-19(26)16-17(29-16)20(27)28/h1-3,7-8,15-17,22H,4-6,9-13,21H2,(H,23,25)(H,24,26)(H,27,28)/t15-,16?,17?/m0/s1
InChIKey: VMUJCCBLIGGNAX-GTPINHCMSA-N
Reference
TMC-52A to D, Novel Cysteine Proteinase Inhibitors, Produced by Gliocladium sp.
PubChem CID: 70678747
LOTUS: LTS0194849
NPASS: NPC327326
{NPAtlas: NPA006325
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Gliocladium sp. | Gliocladium | None | Hypocreales | Sordariomycetes | Ascomycota | Fungi | Eukaryota |
| Gliocladium sp. | Gliocladium | None | Hypocreales | Sordariomycetes | Ascomycota | Fungi | Eukaryota |
| Gliocladium sp. | Gliocladium | None | Hypocreales | Sordariomycetes | Ascomycota | Fungi | Eukaryota |
Properties Information
Molecule Weight: 406.4830000000001
TPSA？: 153.06
MolLogP？: 1.081300000000002
Number of H-Donors: 5
Number of H-Acceptors: 6
RingCount: 2
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|