Ammonificin A
AlkaPlorer ID: AK050025
Synonym: '(-)-Ammonificin A', 'Ammonificin A'
IUPAC Name: (3S,4R)-8-[(1R)-2-amino-1-hydroxyethyl]-4-(3-bromo-4-hydroxyphenyl)-3-(3-hydroxyphenoxy)-3,4-dihydro-2H-chromen-5-ol
Structure
SMILES: NC[C@H](O)C1=CC=C(O)C2=C1OC[C@@H](OC1=CC=CC(O)=C1)[C@@H]2C1=CC=C(O)C(Br)=C1
InChI: InChI=1S/C23H22BrNO6/c24-16-8-12(4-6-17(16)27)21-20(31-14-3-1-2-13(26)9-14)11-30-23-15(19(29)10-25)5-7-18(28)22(21)23/h1-9,19-21,26-29H,10-11,25H2/t19-,20+,21-/m0/s1
InChIKey: FLXXHDISQKOVSO-HBMCJLEFSA-N
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Thermovibrio ammonificans | Thermovibrio | Desulfurobacteriaceae | Desulfurobacteriales | Aquificae | Aquificota | None | Bacteria |
Properties Information
Molecule Weight: 488.33400000000006
TPSA？: 125.40000000000002
MolLogP？: 3.5299000000000014
Number of H-Donors: 5
Number of H-Acceptors: 7
RingCount: 4
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|