Anolobine; (S)-form
AlkaPlorer ID: AK288052
Synonym: None
IUPAC Name: 3,5-dioxa-11-azapentacyclo[10.7.1.02,6.08,20.014,19]icosa-1(20),2(6),7,14(19),15,17-hexaen-16-ol
Structure
SMILES: OC1=CC2=C(C=C1)C1=C3C(=CC4=C1OCO4)CCNC3C2
InChI: InChI=1S/C17H15NO3/c19-11-1-2-12-10(5-11)6-13-15-9(3-4-18-13)7-14-17(16(12)15)21-8-20-14/h1-2,5,7,13,18-19H,3-4,6,8H2
InChIKey: LTSPCGWFQLHECP-UHFFFAOYSA-N
Reference
PubChem CID: 3462224
CAS: 641-17-8
LOTUS: LTS0144642
NPASS: NPC28341
COCONUT: CNP0155341.2
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Magnolia coco | Magnolia | Magnoliaceae | Magnoliales | Magnoliopsida | Streptophyta | Viridiplantae | Eukaryota |
| None | None | Magnoliaceae | Magnoliales | Magnoliopsida | Streptophyta | Viridiplantae | Eukaryota |
Properties Information
Molecule Weight: 281.311
TPSA？: 50.72
MolLogP？: 2.5308
Number of H-Donors: 2
Number of H-Acceptors: 4
RingCount: 5
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|---|---|---|---|---|
| Mycobacterium sp. | Mycobacterium sp. | MIC | 6.0 | ug.mL-1 | 10.1016/j.ejmech.2017.06.005 |