Molecule

(2S)-2-[(2S)-2-[(2S)-2-hydroxy-3-methylbutanamido]-N,3-dimethylbutanamido]-4-methylpentanoic acid

AlkaPlorer ID: AK257179

Synonym: None

IUPAC Name: (2S)-2-[[(2S)-2-[[(2S)-2-hydroxy-3-methylbutanoyl]amino]-3-methylbutanoyl]-methylamino]-4-methylpentanoic acid

Structure

SMILES: CC(C)C[C@@H](C(=O)O)N(C)C(=O)[C@@H](N=C(O)[C@@H](O)C(C)C)C(C)C

InChI: InChI=1S/C17H32N2O5/c1-9(2)8-12(17(23)24)19(7)16(22)13(10(3)4)18-15(21)14(20)11(5)6/h9-14,20H,8H2,1-7H3,(H,18,21)(H,23,24)/t12-,13-,14-/m0/s1

InChIKey: UKOYQMONAWKXIF-IHRRRGAJSA-N

Reference

Sporidesmolic acid B, a hydroxyacyldipeptide from Sporidesmium bakeri

PubChem CID: 12442974

LOTUS: LTS0056875

SuperNatural Ⅲ: SN0372941-01

NPASS: NPC53718

Source

Species	Genus	Family	Order	Class	Phylum	Kingdom	Domain
Narcissus pseudonarcissus	Narcissus	Amaryllidaceae	Asparagales	Magnoliopsida	Streptophyta	Viridiplantae	Eukaryota
Veronica spuria	Veronica	Plantaginaceae	Lamiales	Magnoliopsida	Streptophyta	Viridiplantae	Eukaryota
Matsumurella chinensis	Matsumurella	Lamiaceae	Lamiales	Magnoliopsida	Streptophyta	Viridiplantae	Eukaryota
Baeospora myosura	Baeospora	Cyphellaceae	Agaricales	Agaricomycetes	Basidiomycota	Fungi	Eukaryota
Lepidolaena clavigera	Lepidolaena	Lepidolaenaceae	Porellales	Jungermanniopsida	Streptophyta	Viridiplantae	Eukaryota
Datura metel	Datura	Solanaceae	Solanales	Magnoliopsida	Streptophyta	Viridiplantae	Eukaryota

Properties Information

Molecule Weight: 344.45200000000006

TPSA？: 110.43

MolLogP？: 1.9421

Number of H-Donors: 3

Number of H-Acceptors: 4

RingCount: 0

Activities Information

Organism	Target Name	Standard Type	Standard Value	Standard Units	doi