2-amino-3-[4-(3,4,5-trihydroxybenzoyloxy)phenyl]propanoic acid

AlkaPlorer ID: AK253848

Synonym: None

IUPAC Name: (2S)-2-amino-3-[4-(3,4,5-trihydroxybenzoyl)oxyphenyl]propanoic acid

Structure

SMILES: N[C@@H](CC1=CC=C(OC(=O)C2=CC(O)=C(O)C(O)=C2)C=C1)C(=O)O

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InChI: InChI=1S/C16H15NO7/c17-11(15(21)22)5-8-1-3-10(4-2-8)24-16(23)9-6-12(18)14(20)13(19)7-9/h1-4,6-7,11,18-20H,5,17H2,(H,21,22)/t11-/m0/s1

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InChIKey: SGUXCLISHNMIEC-NSHDSACASA-N

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Source

Species Genus Family Order Class Phylum Kingdom Domain
Inga laurina Inga Fabaceae Fabales Magnoliopsida Streptophyta Viridiplantae Eukaryota

Properties Information

Molecule Weight: 333.29600000000005

TPSA: 150.31

MolLogP: 0.977

Number of H-Donors: 5

Number of H-Acceptors: 7

RingCount: 2

Activities Information

Organism Target Name Standard Type Standard Value Standard Units doi

Metabolism Information