Molecule

Paraherquamide E

AlkaPlorer ID: AK035985

Synonym: None

IUPAC Name: (1'S,6'S,7'R,8R,9'S)-4,4,6',10',10',13'-hexamethylspiro[10H-[1,4]dioxepino[2,3-g]indole-8,11'-3,13-diazatetracyclo[5.5.2.01,9.03,7]tetradecane]-9,14'-dione

Structure

SMILES: C[C@H]1CCN2C[C@]34C[C@@]5(C(=O)NC6=C5C=CC5=C6OC=CC(C)(C)O5)C(C)(C)[C@@H]3C[C@]12C(=O)N4C

InChI: InChI=1S/C28H35N3O4/c1-16-9-11-31-15-26-14-27(25(4,5)19(26)13-28(16,31)23(33)30(26)6)17-7-8-18-21(20(17)29-22(27)32)34-12-10-24(2,3)35-18/h7-8,10,12,16,19H,9,11,13-15H2,1-6H3,(H,29,32)/t16-,19-,26+,27+,28+/m0/s1

InChIKey: XNXXZRQPTAQILV-PYGUQFFJSA-N

Reference

Insecticidal Activity of Paraherquamides, Including Paraherquamide H and Paraherquamide I, Two New Alkaloids Isolated from <i>Penicillium cluniae</i>

PubChem CID: 9898611

LOTUS: LTS0075232

SuperNatural Ⅲ: SN0435361-05

NPASS: NPC250960

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NPAtlas: NPA005172

data_source: manually

Source

Species	Genus	Family	Order	Class	Phylum	Kingdom	Domain
Uvaria tanzaniae	Uvaria	Annonaceae	Magnoliales	Magnoliopsida	Streptophyta	Viridiplantae	Eukaryota
Amansia glomerata	Amansia	Rhodomelaceae	Ceramiales	Florideophyceae	Rhodophyta	None	Eukaryota
Turbo stenogyrus	Turbo	Turbinidae	Trochida	Gastropoda	Mollusca	Metazoa	Eukaryota
Senecio serra	Senecio	Asteraceae	Asterales	Magnoliopsida	Streptophyta	Viridiplantae	Eukaryota
Entada abyssinica	Entada	Fabaceae	Fabales	Magnoliopsida	Streptophyta	Viridiplantae	Eukaryota

Properties Information

Molecule Weight: 477.6050000000003

TPSA？: 71.11

MolLogP？: 3.681200000000002

Number of H-Donors: 1

Number of H-Acceptors: 5

RingCount: 8

Activities Information

Organism	Target Name	Standard Type	Standard Value	Standard Units	doi
Oncopeltus fasciatus	Oncopeltus fasciatus	LD50	0.089	ug	10.1021/jf0530998