Vicibactin-7101
AlkaPlorer ID: AK072780
Synonym: None
IUPAC Name: (2R,9R,12R,19R,22R,29R)-9,19,29-triamino-5,15,25-trihydroxy-2,12,22-trimethyl-1,11,21-trioxa-5,15,25-triazacyclotriacontane-4,10,14,20,24,30-hexone
Structure
SMILES: C[C@@H]1CC(=O)N(O)CCC[C@@H](N)C(=O)O[C@H](C)CC(=O)N(O)CCC[C@@H](N)C(=O)O[C@H](C)CC(=O)N(O)CCC[C@@H](N)C(=O)O1
InChI: InChI=1S/C27H48N6O12/c1-16-13-22(34)31(40)10-5-8-20(29)26(38)44-18(3)15-24(36)33(42)12-6-9-21(30)27(39)45-17(2)14-23(35)32(41)11-4-7-19(28)25(37)43-16/h16-21,40-42H,4-15,28-30H2,1-3H3/t16-,17-,18-,19-,20-,21-/m1/s1
InChIKey: QKQHATWRIIIRSS-UCGFNCKJSA-N
Reference
PubChem CID: 139587939
LOTUS: LTS0234374
SuperNatural Ⅲ: SN0308060-02
{NPAtlas: NPA017435
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Rhizobium leguminosarum | Rhizobium | Rhizobiaceae | Hyphomicrobiales | Alphaproteobacteria | Pseudomonadota | None | Bacteria |
Properties Information
Molecule Weight: 648.7110000000001
TPSA？: 278.58000000000004
MolLogP？: -1.0586999999999904
Number of H-Donors: 6
Number of H-Acceptors: 15
RingCount: 1
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|