None

AlkaPlorer ID: AK325293

Synonym: None

IUPAC Name: (1R,4E,7R,9S)-4-(1H-imidazol-5-ylmethylidene)-9-(2-methylbut-3-en-2-yl)-2,5,16-triazatetracyclo[7.7.0.02,7.010,15]hexadeca-10,12,14-triene-3,6-dione

Structure

SMILES: C=CC(C)(C)[C@]12C[C@@H]3C(O)=N/C(=C/C4=CN=CN4)C(=O)N3[C@H]1NC1=CC=CC=C12

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InChI: InChI=1S/C22H23N5O2/c1-4-21(2,3)22-10-17-18(28)25-16(9-13-11-23-12-24-13)19(29)27(17)20(22)26-15-8-6-5-7-14(15)22/h4-9,11-12,17,20,26H,1,10H2,2-3H3,(H,23,24)(H,25,28)/b16-9+/t17-,20-,22+/m1/s1

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InChIKey: SPWSUFUPTSJWNG-TUPJAARHSA-N

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Reference

PubChem CID: 124708075

NPASS: NPC74033

Source

Species Genus Family Order Class Phylum Kingdom Domain
Aglaia leptantha Aglaia Meliaceae Sapindales Magnoliopsida Streptophyta Viridiplantae Eukaryota

Properties Information

Molecule Weight: 389.4590000000001

TPSA: 93.61

MolLogP: 3.2234000000000016

Number of H-Donors: 3

Number of H-Acceptors: 4

RingCount: 5

Activities Information

Organism Target Name Standard Type Standard Value Standard Units doi

Metabolism Information