Molecule

Vicibactin-7101

AlkaPlorer ID: AK072779

Synonym: None

IUPAC Name: (2R,9S,12R,19S,22R,29S)-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-SQDPYLFBSA-N

Reference

Enzymatic Tailoring of Ornithine in the Biosynthesis of the <i>Rhizobium</i> Cyclic Trihydroxamate Siderophore Vicibactin

PubChem CID: 162928547

LOTUS: LTS0162691

SuperNatural Ⅲ: SN0308060-01

Source

Species	Genus	Family	Order	Class	Phylum	Kingdom	Domain
Rhizobium etli	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