Gentamicin C1a; 3''-N-De-Me
AlkaPlorer ID: AK126537
Synonym: 3''-N-Demethylgentamicin C1a
IUPAC Name: 4-amino-2-[4,6-diamino-3-[3-amino-6-(aminomethyl)oxan-2-yl]oxy-2-hydroxycyclohexyl]oxy-5-methyloxane-3,5-diol
Structure
SMILES: CC1(O)COC(OC2C(N)CC(N)C(OC3OC(CN)CCC3N)C2O)C(O)C1N
InChI: InChI=1S/C18H37N5O7/c1-18(26)6-27-17(12(25)15(18)23)30-14-10(22)4-9(21)13(11(14)24)29-16-8(20)3-2-7(5-19)28-16/h7-17,24-26H,2-6,19-23H2,1H3
InChIKey: DKQSXMKMHKYPEJ-UHFFFAOYSA-N
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Micromonospora sagamiensis | Micromonospora | Micromonosporaceae | Micromonosporales | Actinomycetes | Actinomycetota | None | Bacteria |
Properties Information
Molecule Weight: 435.5220000000002
TPSA？: 227.71
MolLogP？: -4.237399999999997
Number of H-Donors: 8
Number of H-Acceptors: 12
RingCount: 3
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|