3097-B1 (CHEBI:197558)

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This entity has been annotated by a third party. If you would like more information added to this entry, please contact ChEBI via email or GitHub.

ChEBI Name	3097-B1

ChEBI ID	CHEBI:197558

Stars	This entity has been manually annotated by a third party.

Submitter	MetaboLights

Supplier Information

Download	Molfile XML SDF

Formula

C15H21NO4

Net Charge

Average Mass

279.336

Monoisotopic Mass

279.14706

InChI

InChI=1S/C15H21NO4/c1-3-14(18)20-15-12(16-9-13(15)17)8-10-4-6-11(19-2)7-5-10/h4-7,12-13,15-17H,3,8-9H2,1-2H3/t12-,13-,15-/m0/s1

InChIKey

HOTSKSXDTYBKBM-YDHLFZDLSA-N

SMILES

O=C(O[C@@H]1[C@@H](O)CN[C@H]1CC2=CC=C(OC)C=C2)CC

Metabolite of Species	Details
Streptomyces (NCBI:txid1883)	See: PubMed

ChEBI Ontology
Outgoing	3097-B1 (CHEBI:197558) is a methoxybenzenes (CHEBI:51683)

IUPAC Name

[(2S,3S,4S)-4-hydroxy-2-[(4-methoxyphenyl)methyl]pyrrolidin-3-yl] propanoate