(S)-tetrahydrocolumbamine

(<i>S</i>)-tetrahydrocolumbamine




Chemical Formula:
C20H23NO4
Molecular Weight:
341.406 Daltons
Monoisotopic Mass:
341.1627082319 Daltons
SMILES:
C2(CC1(C=C(OC)C(O)=CC=1[CH]3(CC4(C=CC(OC)=C(OC)C(CN23)=4))))
InChI:
1S/C20H23NO4/c1-23-18-5-4-12-8-16-14-10-17(22)19(24-2)9-13(14)6-7-21(16)11-15(12)20(18)25-3/h4-5,9-10,16,22H,6-8,11H2,1-3H3/t16-/m0/s1
InChIKey:
KDFKJOFJHSVROC-INIZCTEOSA-N

Synonyms
  • 5, 8, 13, 13a-tetrahydrocolumbamine
  • isocorypalmine
  • (13aS)-5, 8,13,13a-tetrahydro-3, 9,10-trimethoxy-6H-dibenzo [a, g] quinolizin-2-ol

Databases
MetaCyc:  S-TETRAHYDROCOLUMBAMINE
MetaboLights:  MTBLC17772
ChemSpider:  389213
PubChem (CID):  440229
ChEBI:  17772
KEGG:  C04118
CAS:  483-34-1
RefMet:  (S)-Tetrahydrocolumbamine
Seed:  cpd02545
MetaNetX:  MNXM1303