Isariins; Isariin C2 

AlkaPlorer ID: AK302714

Synonym: None

IUPAC Name: 19-butyl-6-methyl-9-(2-methylpropyl)-3,12-di(propan-2-yl)-1-oxa-4,7,10,13,16-pentazacyclononadecane-2,5,8,11,14,17-hexone

Structure

SMILES: CCCCC1CC(=O)NCC(=O)NC(C(C)C)C(=O)NC(CC(C)C)C(=O)NC(C)C(=O)NC(C(C)C)C(=O)O1

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InChI: InChI=1S/C28H49N5O7/c1-9-10-11-19-13-21(34)29-14-22(35)32-23(16(4)5)27(38)31-20(12-15(2)3)26(37)30-18(8)25(36)33-24(17(6)7)28(39)40-19/h15-20,23-24H,9-14H2,1-8H3,(H,29,34)(H,30,37)(H,31,38)(H,32,35)(H,33,36)

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InChIKey: MMGAMUCWYNLSNI-UHFFFAOYSA-N

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Reference

PubChem CID: 44715310

COCONUT: CNP0456934.1

Source

Species Genus Family Order Class Phylum Kingdom Domain
Isaria sp. Isaria Cordycipitaceae Hypocreales Sordariomycetes Ascomycota Fungi Eukaryota

Properties Information

Molecule Weight: 567.7280000000002

TPSA: 171.79999999999998

MolLogP: 0.9255000000000057

Number of H-Donors: 5

Number of H-Acceptors: 7

RingCount: 1

Activities Information

Organism Target Name Standard Type Standard Value Standard Units doi

Metabolism Information