(2S)-2-[bis(3,4,5-trihydroxybenzoyl)amino]-3-(4-hydroxyphenyl)propanoic acid

AlkaPlorer ID: AK457705

Synonym: None

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

Structure

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

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InChI: InChI=1S/C23H19NO11/c25-13-3-1-10(2-4-13)5-14(23(34)35)24(21(32)11-6-15(26)19(30)16(27)7-11)22(33)12-8-17(28)20(31)18(29)9-12/h1-4,6-9,14,25-31H,5H2,(H,34,35)/t14-/m0/s1

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InChIKey: MNFJPYYKOBNUEG-AWEZNQCLSA-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: 485.4010000000002

TPSA: 216.29

MolLogP: 1.6043000000000005

Number of H-Donors: 8

Number of H-Acceptors: 10

RingCount: 3

Activities Information

Organism Target Name Standard Type Standard Value Standard Units doi

Metabolism Information