Muraminomicin E1
AlkaPlorer ID: AK122393
Synonym: None
IUPAC Name: 2-[[(2S,4S,5R)-5-(aminomethyl)-4-hydroxyoxolan-2-yl]oxy-[(2S,3S,5R)-5-(2,4-dioxopyrimidin-1-yl)-3-hydroxyoxolan-2-yl]methyl]-6-[3-[5-[4-(3-carboxypropanoyloxy)-6-ethyl-3,5-dimethoxyoxan-2-yl]oxy-3-methyl-5-oxopentanoyl]oxy-12-methyltridecanoyl]oxy-1,4-dimethyl-3-oxo-1,4-diazepane-5-carboxylic acid
Structure
SMILES: CCC1OC(OC(=O)CC(C)CC(=O)OC(CCCCCCCCC(C)C)CC(=O)OC2CN(C)C(C(O[C@H]3C[C@H](O)[C@@H](CN)O3)[C@H]3O[C@@H](N4C=CC(O)=NC4=O)C[C@@H]3O)C(=O)N(C)C2C(=O)O)C(OC)C(OC(=O)CCC(=O)O)C1OC
InChI: InChI=1S/C55H87N5O23/c1-9-34-48(74-7)50(81-40(66)19-18-39(64)65)51(75-8)54(79-34)82-42(68)23-30(4)22-41(67)76-31(17-15-13-11-10-12-14-16-29(2)3)24-43(69)77-36-28-58(5)46(52(70)59(6)45(36)53(71)72)49(83-44-26-32(61)35(27-56)78-44)47-33(62)25-38(80-47)60-21-20-37(63)57-55(60)73/h20-21,29-36,38,44-51,54,61-62H,9-19,22-28,56H2,1-8H3,(H,64,65)(H,71,72)(H,57,63,73)/t30?,31?,32-,33-,34?,35+,36?,38+,44-,45?,46?,47-,48?,49?,50?,51?,54?/m0/s1
InChIKey: AOVUYWDHRJJSCT-IPSUJDRFSA-N
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Streptosporangium sp. | Streptosporangium | Streptosporangiaceae | Streptosporangiales | Actinomycetes | Actinomycetota | None | Bacteria |
Properties Information
Molecule Weight: 1186.3130000000003
TPSA？: 380.3300000000001
MolLogP？: 1.5342000000000124
Number of H-Donors: 6
Number of H-Acceptors: 25
RingCount: 5
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|