17-Methylenespiramycin
AlkaPlorer ID: AK041891
Synonym: None
IUPAC Name: 2-[(5S,6S,7R,9R,11Z,13Z,16R)-6-[5-(4,5-dihydroxy-4,6-dimethyloxan-2-yl)oxy-4-(dimethylamino)-3-hydroxy-6-methyloxan-2-yl]oxy-10-[5-(dimethylamino)-6-methyloxan-2-yl]oxy-4-hydroxy-5-methoxy-9,16-dimethyl-2-oxo-1-oxacyclohexadeca-11,13-dien-7-yl]prop-2-enal
Structure
SMILES: C=C(C=O)[C@H]1C[C@@H](C)C(OC2CCC(N(C)C)C(C)O2)/C=C\C=C/C[C@@H](C)OC(=O)CC(O)[C@H](OC)[C@H]1OC1OC(C)C(OC2CC(C)(O)C(O)C(C)O2)C(N(C)C)C1O
InChI: InChI=1S/C44H74N2O14/c1-24-20-30(25(2)23-47)40(60-43-38(50)37(46(10)11)39(28(5)57-43)59-36-22-44(7,52)42(51)29(6)56-36)41(53-12)32(48)21-34(49)54-26(3)16-14-13-15-17-33(24)58-35-19-18-31(45(8)9)27(4)55-35/h13-15,17,23-24,26-33,35-43,48,50-52H,2,16,18-22H2,1,3-12H3/b14-13-,17-15-/t24-,26-,27?,28?,29?,30-,31?,32?,33?,35?,36?,37?,38?,39?,40+,41+,42?,43?,44?/m1/s1
InChIKey: SPUCVXIQVCUVAK-BUOLHCRLSA-N
Reference
Two Novel Spiramycins Obtained from Commercial Samples: Isolation and Elucidation of Structure.
PubChem CID: 139586349
LOTUS: LTS0227186
{NPAtlas: NPA011709
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Streptomyces ambofaciens | Streptomyces | Streptomycetaceae | Kitasatosporales | Actinomycetes | Actinomycetota | None | Bacteria |
Properties Information
Molecule Weight: 855.0760000000004
TPSA？: 195.38
MolLogP？: 2.491200000000008
Number of H-Donors: 4
Number of H-Acceptors: 16
RingCount: 4
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|