Mycinamicin XIII
AlkaPlorer ID: AK011290
Synonym: 'Mycinamicin XIII', 'Mycinamycin XIII'
IUPAC Name: (1R,2R,3R,6E,8S,9R,10S,12R,14E,16R)-9-[(2R,3R,4S,6R)-4-(dimethylamino)-3-hydroxy-6-methyloxan-2-yl]oxy-2-hydroxy-2-[[(2S,3S,4S,5R,6R)-5-hydroxy-3,4-dimethoxy-6-methyloxan-2-yl]oxymethyl]-3,8,10,12-tetramethyl-4,17-dioxabicyclo[14.1.0]heptadeca-6,14-diene-5,13-dione
Structure
SMILES: CO[C@@H]1[C@@H](OC[C@]2(O)[C@@H]3O[C@@H]3/C=C/C(=O)[C@H](C)C[C@H](C)[C@@H](O[C@H]3O[C@H](C)C[C@H](N(C)C)[C@H]3O)[C@@H](C)/C=C/C(=O)O[C@@H]2C)O[C@H](C)[C@@H](O)[C@@H]1OC
InChI: InChI=1S/C36H59NO13/c1-18-11-14-27(39)48-23(6)36(42,17-45-35-32(44-10)31(43-9)28(40)22(5)47-35)33-26(49-33)13-12-25(38)19(2)15-20(3)30(18)50-34-29(41)24(37(7)8)16-21(4)46-34/h11-14,18-24,26,28-35,40-42H,15-17H2,1-10H3/b13-12+,14-11+/t18-,19+,20-,21+,22+,23+,24-,26+,28+,29+,30-,31-,32-,33+,34+,35-,36+/m0/s1
InChIKey: DDSYZRYNMPREDI-MLEYCKPESA-N
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Micromonospora griseorubida | Micromonospora | Micromonosporaceae | Micromonosporales | Actinomycetes | Actinomycetota | None | Bacteria |
Properties Information
Molecule Weight: 713.8620000000003
TPSA？: 175.20999999999995
MolLogP？: 1.373600000000006
Number of H-Donors: 3
Number of H-Acceptors: 14
RingCount: 4
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|