Molecule

Veraguamide K; Lower homologue (R = -CH(CH3)2)

AlkaPlorer ID: AK317462

Synonym: Veraguamide L

IUPAC Name: ethyl 2-[[1-[2-[2-[[2-[(8-bromo-3-hydroxy-2-methyloct-7-ynoyl)amino]-3-methylbutanoyl]-methylamino]-3-methylbutanoyl]oxy-3-methylbutanoyl]pyrrolidine-2-carbonyl]-methylamino]-3-methylbutanoate

Structure

SMILES: CCOC(=O)C(C(C)C)N(C)C(=O)C1CCCN1C(=O)C(OC(=O)C(C(C)C)N(C)C(=O)C(N=C(O)C(C)C(O)CCCC#CBr)C(C)C)C(C)C

InChI: InChI=1S/C38H63BrN4O9/c1-13-51-37(49)30(23(4)5)41(11)34(46)27-18-17-21-43(27)36(48)32(25(8)9)52-38(50)31(24(6)7)42(12)35(47)29(22(2)3)40-33(45)26(10)28(44)19-15-14-16-20-39/h22-32,44H,13-15,17-19,21H2,1-12H3,(H,40,45)

InChIKey: XFJWITCKHVUBEG-UHFFFAOYSA-N

Reference

Cytotoxic Veraguamides, Alkynyl Bromide-Containing Cyclic Depsipeptides from the Marine Cyanobacterium cf. <i>Oscillatoria margaritifera</i>

PubChem CID: 53262812

LOTUS: LTS0169057

COCONUT: CNP0352872.2

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NPAtlas: NPA008457

Source

Species	Genus	Family	Order	Class	Phylum	Kingdom	Domain
None	Margaritifera	Margaritiferidae	Unionida	Bivalvia	Mollusca	Metazoa	Eukaryota

Properties Information

Molecule Weight: 799.8449999999999

TPSA？: 166.35

MolLogP？: 4.5785000000000045

Number of H-Donors: 2

Number of H-Acceptors: 9

RingCount: 1

Activities Information

Organism	Target Name	Standard Type	Standard Value	Standard Units	doi