Dihydroxanthommatin; (S)-form
AlkaPlorer ID: AK295995
Synonym: None
IUPAC Name: 11-(3-amino-3-carboxypropanoyl)-5-hydroxy-1-oxo-4,12-dihydropyrido[3,2-a]phenoxazine-3-carboxylic acid
Structure
SMILES: NC(CC(=O)C1=CC=CC2=C1NC1=C3C(=O)C=C(C(=O)O)NC3=C(O)C=C1O2)C(=O)O
InChI: InChI=1S/C20H15N3O8/c21-8(19(27)28)4-10(24)7-2-1-3-13-16(7)23-18-14(31-13)6-12(26)17-15(18)11(25)5-9(22-17)20(29)30/h1-3,5-6,8,23,26H,4,21H2,(H,22,25)(H,27,28)(H,29,30)
InChIKey: WSRZQBTZCCBWOL-UHFFFAOYSA-N
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Sepia officinalis | Sepia | Sepiidae | Sepiida | Cephalopoda | Mollusca | Metazoa | Eukaryota |
| Loligo vulgaris | Loligo | Loliginidae | Myopsida | Cephalopoda | Mollusca | Metazoa | Eukaryota |
Properties Information
Molecule Weight: 425.3530000000001
TPSA？: 192.04
MolLogP？: 1.7658999999999998
Number of H-Donors: 6
Number of H-Acceptors: 8
RingCount: 4
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|