Borrelidin; 12-Decyano, 12-(aminomethyl)
AlkaPlorer ID: AK290870
Synonym: Borrelidin B, Treponemycin amine
IUPAC Name: 2-[7-(aminomethyl)-8,16-dihydroxy-9,11,13,15-tetramethyl-18-oxo-1-oxacyclooctadeca-4,6-dien-2-yl]cyclopentane-1-carboxylic acid
Structure
SMILES: CC1CC(C)CC(C)C(O)C(CN)=CC=CCC(C2CCCC2C(=O)O)OC(=O)CC(O)C(C)C1
InChI: InChI=1S/C28H47NO6/c1-17-12-18(2)14-20(4)27(32)21(16-29)8-5-6-11-25(22-9-7-10-23(22)28(33)34)35-26(31)15-24(30)19(3)13-17/h5-6,8,17-20,22-25,27,30,32H,7,9-16,29H2,1-4H3,(H,33,34)
InChIKey: HSRFFKHGZLNWNZ-UHFFFAOYSA-N
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Streptomyces sp. RL09-241-NTF-B | Streptomyces | Streptomycetaceae | Kitasatosporales | Actinomycetes | Actinomycetota | None | Bacteria |
Properties Information
Molecule Weight: 493.68500000000034
TPSA？: 130.07999999999998
MolLogP？: 4.070700000000002
Number of H-Donors: 4
Number of H-Acceptors: 6
RingCount: 2
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|