N-acetyl-serotonin glucuronide

Chemical Formula:

C₁₈H₂₁N₂O₈

Molecular Weight:

393.372 Daltons

Monoisotopic Mass:

394.1376156934 Daltons

SMILES:

CC(=O)NCCC2(=CNC3(=CC=C(OC1(OC(C([O-])=O)C(O)C(O)C(O)1))C=C23))

InChI:

1S/C18H22N2O8/c1-8(21)19-5-4-9-7-20-12-3-2-10(6-11(9)12)27-18-15(24)13(22)14(23)16(28-18)17(25)26/h2-3,6-7,13-16,18,20,22-24H,4-5H2,1H3,(H,19,21)(H,25,26)/p-1/t13-,14-,15+,16-,18+/m0/s1

InChIKey:

DRKQFNYKSNWOTC-RNGZQALNSA-M

Synonyms

N-acetyl-5-hydroxytryptamine glucuronide

Databases

MetaCyc: CPD-12016

RefMet: N-acetylserotoni N-acetylserotonin glucuronide

PubChem (CID): 29971053

Seed: cpd23192

HMDB: HMDB60833

MetaNetX: MNXM587365