2,3-Dihydro-3-hydroxy-2-oxo-1H-indole-3-acetic acid; (ξ)-form, Me ester 

AlkaPlorer ID: AK295825

Synonym: Coixlactam B

IUPAC Name: methyl 2-(3-hydroxy-2-oxo-1H-indol-3-yl)acetate

Structure

SMILES: COC(=O)CC1(O)C(O)=NC2=CC=CC=C21

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InChI: InChI=1S/C11H11NO4/c1-16-9(13)6-11(15)7-4-2-3-5-8(7)12-10(11)14/h2-5,15H,6H2,1H3,(H,12,14)

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InChIKey: BHWUWPHGCCRYBU-UHFFFAOYSA-N

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Reference

PubChem CID: 14033762

CAS: 205656-36-6

NPASS: NPC46324

COCONUT: CNP0330531.2

Properties Information

Molecule Weight: 221.212

TPSA: 79.12

MolLogP: 1.0389

Number of H-Donors: 2

Number of H-Acceptors: 4

RingCount: 2

Activities Information

Organism Target Name Standard Type Standard Value Standard Units doi

Metabolism Information