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name Structure Reference Source Properties Activities Metabolism

(2R,3S)-2-{11-hydroxy-4,10-dioxo-8-phenyl-3-azatricyclo[7.3.1.0⁵,¹³]trideca-1,5(13),6,8,11-pentaen-3-yl}-3-methylpentanoic acid

AlkaPlorer ID: AK262256

Synonym: None

IUPAC Name: (2R,3S)-2-(5-hydroxy-1,6-dioxo-7-phenylbenzo[de]isoquinolin-2-yl)-3-methylpentanoic acid

Structure

SMILES: CC[C@H](C)[C@H](C(=O)O)N1C=C2C=C(O)C(=O)C3=C(C4=CC=CC=C4)C=CC(=C23)C1=O

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InChI: InChI=1S/C24H21NO5/c1-3-13(2)21(24(29)30)25-12-15-11-18(26)22(27)20-16(14-7-5-4-6-8-14)9-10-17(19(15)20)23(25)28/h4-13,21,26H,3H2,1-2H3,(H,29,30)/t13-,21+/m0/s1

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InChIKey: RVOHRYJJXCFNQS-YEJXKQKISA-N

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Source

Species Genus Family Order Class Phylum Kingdom Domain
Lachnanthes caroliniana Lachnanthes Haemodoraceae Commelinales Magnoliopsida Streptophyta Viridiplantae Eukaryota

Properties Information

Molecule Weight: 403.4340000000001

TPSA？: 96.6

MolLogP？: 4.435500000000003

Number of H-Donors: 2

Number of H-Acceptors: 5

RingCount: 4

Activities Information

Organism Target Name Standard Type Standard Value Standard Units doi

Metabolism Information