Juvenimicin B1; 12S,13S-Epoxide
AlkaPlorer ID: AK303389
Synonym: Juvenimicin A4, 20-Deoxo-20-hydroxyrosamicin, Izenamicin A2, M 4365A2, Antibiotic M4365A2, 6108A2, Antibiotic 6108A2
IUPAC Name: 9-[4-(dimethylamino)-3-hydroxy-6-methyloxan-2-yl]oxy-3-ethyl-7-hydroxy-10-(2-hydroxyethyl)-2,8,12,16-tetramethyl-4,17-dioxabicyclo[14.1.0]heptadec-14-ene-5,13-dione
Structure
SMILES: CCC1OC(=O)CC(O)C(C)C(OC2OC(C)CC(N(C)C)C2O)C(CCO)CC(C)C(=O)C=CC2(C)OC2C1C
InChI: InChI=1S/C31H53NO9/c1-9-25-20(5)29-31(6,41-29)12-10-23(34)17(2)14-21(11-13-33)28(19(4)24(35)16-26(36)39-25)40-30-27(37)22(32(7)8)15-18(3)38-30/h10,12,17-22,24-25,27-30,33,35,37H,9,11,13-16H2,1-8H3
InChIKey: GRMXJKDVOPKCDG-UHFFFAOYSA-N
Reference
Macrolide antibiotics M-4365 produced by Micromonospora. II. Chemical structures.
PubChem CID: 71425
LOTUS: LTS0039582
COCONUT: CNP0235576.3
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Micromonospora chalcea | Micromonospora | Micromonosporaceae | Micromonosporales | Actinomycetes | Actinomycetota | None | Bacteria |
| Micromonospora rosaria | Micromonospora | Micromonosporaceae | Micromonosporales | Actinomycetes | Actinomycetota | None | Bacteria |
| None | Micromonospora | Micromonosporaceae | Micromonosporales | Actinomycetes | Actinomycetota | None | Bacteria |
Properties Information
Molecule Weight: 583.7630000000004
TPSA？: 138.29000000000002
MolLogP？: 2.4638000000000018
Number of H-Donors: 3
Number of H-Acceptors: 10
RingCount: 3
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|