Teicoplanin; Teicoplanin A2-3, 4',5'Z-Didehydro, 15-deamino, 15-oxo
AlkaPlorer ID: AK315107
Synonym: Teico 2-1
IUPAC Name: None
Structure
SMILES: CCCCC/C=C/CCC(=O)NC1C(OC2=C3C=C4C=C2OC2=CC=C(C=C2Cl)C(OC2OC(CO)C(O)C(O)C2NC(C)=O)C2NC(=O)C(NC(=O)C4NC(=O)C4NC(=O)C(CC5=CC=C(O3)C(Cl)=C5)NC(=O)C(=O)C3=CC=C(O)C(=C3)OC3=CC(O)=CC4=C3)C3=CC=C(O)C(=C3)C3=C(OC4OC(CO)C(O)C(O)C4O)C=C(O)C=C3C(C(=O)O)NC2=O)OC(CO)C(O)C1O
InChI: InChI=1S/C88H92Cl2N8O34/c1-3-4-5-6-7-8-9-10-60(107)93-67-74(113)71(110)58(32-100)129-87(67)132-78-55-26-40-27-56(78)126-52-18-14-38(24-47(52)90)77(131-86-66(91-34(2)102)73(112)70(109)57(31-99)128-86)68-83(120)97-65(85(122)123)45-29-42(104)30-54(127-88-76(115)75(114)72(111)59(33-101)130-88)61(45)44-23-36(12-15-49(44)105)62(80(117)98-68)95-82(119)64(40)96-81(118)63-39-21-41(103)28-43(22-39)124-53-25-37(13-16-50(53)106)69(108)84(121)92-48(79(116)94-63)20-35-11-17-51(125-55)46(89)19-35/h7-8,11-19,21-30,48,57-59,62-68,70-77,86-88,99-101,103-106,109-115H,3-6,9-10,20,31-33H2,1-2H3,(H,91,102)(H,92,121)(H,93,107)(H,94,116)(H,95,119)(H,96,118)(H,97,120)(H,98,117)(H,122,123)/b8-7+
InChIKey: CAAMQXOTIVYSMX-BQYQJAHWSA-N
Reference
CAS: 179730-25-7
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Actinoplanes teichomyceticus | Actinoplanes | Micromonosporaceae | Micromonosporales | Actinomycetes | Actinomycetota | None | Bacteria |
Properties Information
Molecule Weight: 1876.632000000001
TPSA？: 653.4600000000003
MolLogP？: 1.1225000000000072
Number of H-Donors: 23
Number of H-Acceptors: 33
RingCount: 16
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|