Pseudobactin 7SR1; 3'-Deoxy
AlkaPlorer ID: AK311458
Synonym: None
IUPAC Name: None
Structure
SMILES: CC(=O)N(O)CCCC(NC(=O)C(CO)NC(=O)C1CCN=C2C(NC(=O)CCC(N)=O)=CC3=CC(O)=C(O)C=C3N21)C(=O)NC(C)C(=O)NCC(=O)NC1COC(=O)C(C(C)O)NC(=O)C(C(O)C(=O)O)NC(=O)C(CO)NC1=O
InChI: InChI=1S/C46H63N13O22/c1-18(38(70)49-14-33(68)52-26-17-81-46(79)34(19(2)62)56-44(76)35(36(69)45(77)78)57-41(73)25(16-61)54-42(26)74)50-39(71)22(5-4-10-58(80)20(3)63)53-40(72)24(15-60)55-43(75)27-8-9-48-37-23(51-32(67)7-6-31(47)66)11-21-12-29(64)30(65)13-28(21)59(27)37/h11-13,18-19,22,24-27,34-36,60-62,64-65,69,80H,4-10,14-17H2,1-3H3,(H2,47,66)(H,49,70)(H,50,71)(H,51,67)(H,52,68)(H,53,72)(H,54,74)(H,55,75)(H,56,76)(H,57,73)(H,77,78)
InChIKey: DWQQKQJXBXFPCW-UHFFFAOYSA-N
Reference
CAS: 280142-33-8
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Pseudomonas fluorescens | Pseudomonas | Pseudomonadaceae | Pseudomonadales | Gammaproteobacteria | Pseudomonadota | None | Bacteria |
Properties Information
Molecule Weight: 1150.0790000000006
TPSA？: 546.1099999999999
MolLogP？: -9.273500000000023
Number of H-Donors: 18
Number of H-Acceptors: 23
RingCount: 4
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|