Molecule

Paraherquamide G

AlkaPlorer ID: AK456933

Synonym: None

IUPAC Name: 6'-hydroxy-6',7,7,10',10',13'-hexamethylspiro[1H-pyrano[2,3-g]indole-3,11'-3,13-diazatetracyclo[5.5.2.01,9.03,7]tetradecane]-2,14'-dione

Structure

SMILES: CN1C(=O)C23CC4C1(CN2CCC3(C)O)CC1(C(O)=NC2=C3C=CC(C)(C)OC3=CC=C21)C4(C)C

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

InChIKey: MLMCOAUMNMJPGN-UHFFFAOYSA-N

Reference

Novel antinematodal and antiparasitic agents from Penicillium charlesii. II. Structure determination of paraherquamides B, C, D, E, F, and G.

PubChem CID: 14734727

CAS: 125600-55-7

LOTUS: LTS0145421

COCONUT: CNP0380634.4

Source

Species	Genus	Family	Order	Class	Phylum	Kingdom	Domain
Penicillium paraherquei	Penicillium	Aspergillaceae	Eurotiales	Eurotiomycetes	Ascomycota	Fungi	Eukaryota

Properties Information

Molecule Weight: 477.60500000000025

TPSA？: 85.60000000000001

MolLogP？: 3.5663000000000027

Number of H-Donors: 2

Number of H-Acceptors: 5

RingCount: 8

Activities Information

Organism	Target Name	Standard Type	Standard Value	Standard Units	doi