Ileabethoxazole
AlkaPlorer ID: AK002602
Synonym: None
IUPAC Name: (E)-2-methyl-4-[(9S,10R,11R,14S)-7,10,14-trimethyl-3-oxa-5-azatetracyclo[6.6.1.02,6.011,15]pentadeca-1(15),2(6),4,7-tetraen-9-yl]but-3-en-2-ol
Structure
SMILES: C[C@H]1CC[C@@H]2[C@H]([C@@H](C3=C(C4=C(C1=C23)OC=N4)C)/C=C/C(C)(C)O)C
InChI: InChI=1S/C21H27NO2/c1-11-6-7-14-12(2)15(8-9-21(4,5)23)17-13(3)19-20(24-10-22-19)16(11)18(14)17/h8-12,14-15,23H,6-7H2,1-5H3/b9-8+/t11-,12+,14+,15-/m0/s1
InChIKey: JSKUEIQCYRLEIS-JIDGNWBMSA-N
Reference
Ileabethoxazole: a novel benzoxazole alkaloid with antimycobacterial activity
PubChem CID: 9549062
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Antillogorgia elisabethae | Antillogorgia | Gorgoniidae | Malacalcyonacea | Anthozoa | Cnidaria | Metazoa | Eukaryota |
Properties Information
Molecule Weight: 325.45200000000006
TPSA？: 46.260000000000005
MolLogP？: 5.177520000000006
Number of H-Donors: 1
Number of H-Acceptors: 3
RingCount: 4
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|