dihydrochanoclavine-I aldehyde

Chemical Formula:

C₁₆H₂₁N₂O

Molecular Weight:

257.355 Daltons

Monoisotopic Mass:

257.1653883066 Daltons

SMILES:

CC(C=O)C[CH]1([CH](CC3(C2(=C1C=CC=C2NC=3)))[N+]C)

InChI:

1S/C16H20N2O/c1-10(9-19)6-13-12-4-3-5-14-16(12)11(8-18-14)7-15(13)17-2/h3-5,8-10,13,15,17-18H,6-7H2,1-2H3/p+1/t10?,13-,15-/m1/s1

InChIKey:

FZMIVISXXWRICN-SKNXHYNKSA-O

Synonyms

(6R,7R)-N-methyl-7-(2-methyl-3-oxopropyl)-2-azatricyclo[6.3.1.0^4,12]dodeca-1(11),3,8(12),9-tetraen-6-aminium

Databases

MetaCyc: CPD-14465

PubChem (CID): 57339209

MetaboLights: MTBLC65032

ChEBI: 65032

MetaNetX: MNXM97506