Alachalasin A; 19-Deoxy

AlkaPlorer ID: AK283650

Synonym: Alachalasin C

IUPAC Name: 13-hydroxy-5,8,14,15,17-pentamethyl-6-oxa-18-azatetracyclo[10.7.0.01,16.05,7]nonadeca-10,14-diene-2,19-dione

Structure

SMILES: CC1=C(C)C2C(C)NC(=O)C23C(=O)CCC2(C)OC2C(C)CC=CC3C1O

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InChI: InChI=1S/C22H31NO4/c1-11-7-6-8-15-18(25)13(3)12(2)17-14(4)23-20(26)22(15,17)16(24)9-10-21(5)19(11)27-21/h6,8,11,14-15,17-19,25H,7,9-10H2,1-5H3,(H,23,26)

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InChIKey: HXJVVHDBQIRNEB-UHFFFAOYSA-N

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Reference

PubChem CID: 162974041

COCONUT: CNP0245701.1

Source

Species Genus Family Order Class Phylum Kingdom Domain
Podospora vesticola Podospora Podosporaceae Sordariales Sordariomycetes Ascomycota Fungi Eukaryota

Properties Information

Molecule Weight: 373.493

TPSA: 78.93

MolLogP: 2.537200000000001

Number of H-Donors: 2

Number of H-Acceptors: 4

RingCount: 4

Activities Information

Organism Target Name Standard Type Standard Value Standard Units doi

Metabolism Information