SP-Chymostatin B; 1-Alcohol
AlkaPlorer ID: AK313827
Synonym: Antibiotic Mer-N 5075A, Mer-N 5075A
IUPAC Name: 2-[[5-(diaminomethylideneamino)-1-[[1-[(1-hydroxy-3-phenylpropan-2-yl)amino]-3-methyl-1-oxobutan-2-yl]amino]-1-oxopentan-2-yl]carbamoylamino]-3-phenylpropanoic acid
Structure
SMILES: CC(C)C(N=C(O)C(CCCNC(=N)N)N=C(O)NC(CC1=CC=CC=C1)C(=O)O)C(O)=NC(CO)CC1=CC=CC=C1
InChI: InChI=1S/C30H43N7O6/c1-19(2)25(27(40)34-22(18-38)16-20-10-5-3-6-11-20)37-26(39)23(14-9-15-33-29(31)32)35-30(43)36-24(28(41)42)17-21-12-7-4-8-13-21/h3-8,10-13,19,22-25,38H,9,14-18H2,1-2H3,(H,34,40)(H,37,39)(H,41,42)(H4,31,32,33)(H2,35,36,43)
InChIKey: FWFRRBPYKRBFLL-UHFFFAOYSA-N
Reference
Mer-N5075A, a potential HIV-1 protease inhibitor, produced by Streptomyces chromofuscus.
PubChem CID: 10461167
LOTUS: LTS0233829
COCONUT: CNP0343294.1
{NPAtlas: NPA019726
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Streptomyces chromofuscus | Streptomyces | Streptomycetaceae | Kitasatosporales | Actinomycetes | Actinomycetota | None | Bacteria |
Properties Information
Molecule Weight: 597.7170000000001
TPSA？: 229.23
MolLogP？: 2.3589700000000047
Number of H-Donors: 9
Number of H-Acceptors: 6
RingCount: 2
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|