Molecule

Medusamide A

AlkaPlorer ID: AK305403

Synonym: None

IUPAC Name: 9,13,17,21-tetramethyl-25-(2-methylpropyl)-3,6-di(propan-2-yl)-10,14,18,22-tetrapropyl-1,4-dioxa-7,11,15,19,23-pentazacyclopentacosane-2,5,8,12,16,20,24-heptone

Structure

SMILES: CCCC1NC(=O)C(CC(C)C)OC(=O)C(C(C)C)OC(=O)C(C(C)C)NC(=O)C(C)C(CCC)NC(=O)C(C)C(CCC)NC(=O)C(C)C(CCC)NC(=O)C1C

InChI: InChI=1S/C44H79N5O9/c1-15-19-31-28(12)39(51)47-33(21-17-3)30(14)41(53)49-36(25(7)8)43(55)58-37(26(9)10)44(56)57-35(23-24(5)6)42(54)48-34(22-18-4)29(13)40(52)46-32(20-16-2)27(11)38(50)45-31/h24-37H,15-23H2,1-14H3,(H,45,50)(H,46,52)(H,47,51)(H,48,54)(H,49,53)

InChIKey: ZGUPGLAEKHCUSL-UHFFFAOYSA-N

Reference

FR-900520 and FR-900523, novel immunosuppressants isolated from a Streptomyces. II. Fermentation, isolation and physico-chemical and biological characteristics.

FR-900520 and FR-900523, novel immunosuppressants isolated from a Streptomyces. I. Taxonomy of the producing strain.

PubChem CID: 162981664

COCONUT: CNP0253871.1

Source

Species	Genus	Family	Order	Class	Phylum	Kingdom	Domain
None	Panama	Braconidae	Hymenoptera	Insecta	Arthropoda	Metazoa	Eukaryota

Properties Information

Molecule Weight: 822.1419999999998

TPSA？: 198.1

MolLogP？: 5.350500000000008

Number of H-Donors: 5

Number of H-Acceptors: 9

RingCount: 1

Activities Information

Organism	Target Name	Standard Type	Standard Value	Standard Units	doi