Cordycepeptide A

AlkaPlorer ID: AK292983

Synonym: None

IUPAC Name: 9-benzyl-6-methyl-3-(2-methylhexyl)-13-propan-2-yl-1-oxa-4,7,10-triazacyclotridecane-2,5,8,11-tetrone

Structure

SMILES: CCCCC(C)CC1N=C(O)C(C)N=C(O)C(CC2=CC=CC=C2)N=C(O)CC(C(C)C)OC1=O

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InChI: InChI=1S/C27H41N3O5/c1-6-7-11-18(4)14-22-27(34)35-23(17(2)3)16-24(31)29-21(15-20-12-9-8-10-13-20)26(33)28-19(5)25(32)30-22/h8-10,12-13,17-19,21-23H,6-7,11,14-16H2,1-5H3,(H,28,33)(H,29,31)(H,30,32)

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InChIKey: DAWAFKBGVLXVTN-UHFFFAOYSA-N

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Reference

PubChem CID: 5316064

NPASS: NPC111296

COCONUT: CNP0168545.3

Properties Information

Molecule Weight: 487.64100000000025

TPSA: 124.07000000000002

MolLogP: 5.412200000000005

Number of H-Donors: 3

Number of H-Acceptors: 5

RingCount: 2

Activities Information

Organism Target Name Standard Type Standard Value Standard Units doi

Metabolism Information