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Salsoline-1-carboxylate

Properties

Image

Occurences in reactions

MNX_ID

MNXM81436

	#reac
in my sandbox	0
in MNXref (generic)	1
in models (compartimentalized)	1

formula

C₁₂H₁₅NO₄

charge

mass

237.10011

reference

InChIKey

CJEFWISJWQNPSZ-GFCCVEGCSA-N

InChI

InChI=1S/C12H15NO4/c1-12(11(15)16)8-6-10(17-2)9(14)5-7(8)3-4-13-12/h5-6,13-14H,3-4H2,1-2H3,(H,15,16)/t12-/m1/s1

SMILES

COc1cc2c(cc1O)CCN[C@@]2(C)C(=O)O

Parent-child relations graph

Deprecated MNXref IDs graph

Similar chemical compounds in external resources
Identifier	Description
CHEBI:174215 chebi:174215	Salsoline-1-carboxylate (1R)-6-hydroxy-7-methoxy-1-methyl-3,4-dihydro-2H-isoquinoline-1-carboxylic acid
bigg.metabolite:CE5627 biggM:CE5627	Salsoline-1-carboxylate
hmdb:HMDB0013067	Salsoline-1-carboxylate (1R)-6-Hydroxy-7-methoxy-1-methyl-1,2,3,4-tetrahydroisoquinoline-1-carboxylate (1R)-6-hydroxy-7-methoxy-1-methyl-1,2,3,4-tetrahydroisoquinoline-1-carboxylic acid (1R)-6-hydroxy-7-methoxy-1-methyl-3,4-dihydro-2H-isoquinoline-1-carboxylic acid 1-Methyl-6-hydroxy-7-methoxy-1,2,3,4-tetrahydroisoquinoline-1-carboxylic acid SLN-1C Salsoline-1-carboxylic acid
hmdb:HMDB13067 biggM:M_CE5627	secondary/obsolete/fantasy identifier