Exiguamine A; (±)-form, 17β-Hydroxy
AlkaPlorer ID: AK298161
Synonym: Exiguamine B
IUPAC Name: 16-(2-aminoethyl)-4,9-dihydroxy-1',3',6,6-tetramethylspiro[11-oxa-18-aza-6-azoniapentacyclo[11.7.0.02,10.03,7.015,19]icosa-1(13),2,7,9,15(19),16-hexaene-12,5'-imidazolidine]-2',4',14,20-tetrone
Structure
SMILES: CN1C(=O)N(C)C2(OC3=C(O)C=C4C(=C3C3=C2C(=O)C2=C(NC=C2CCN)C3=O)C(O)C[N+]4(C)C)C1=O
InChI: InChI=1S/C25H25N5O7/c1-28-23(35)25(29(2)24(28)36)18-17(21(34)19-14(20(18)33)10(5-6-26)8-27-19)16-15-11(7-12(31)22(16)37-25)30(3,4)9-13(15)32/h7-8,13,32H,5-6,9,26H2,1-4H3,(H-,27,31,33,34)/p+1
InChIKey: YOXFPJITBOPKPN-UHFFFAOYSA-O
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Neopetrosia exigua | Neopetrosia | Petrosiidae | Haplosclerida | Demospongiae | Porifera | Metazoa | Eukaryota |
Properties Information
Molecule Weight: 508.5110000000004
TPSA？: 166.26
MolLogP？: 0.2806999999999999
Number of H-Donors: 4
Number of H-Acceptors: 8
RingCount: 6
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|