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norcoclaurine

Properties

Image

Occurences in reactions

MNX_ID

MNXM728280

	#reac
in my sandbox	0
in MNXref (generic)	2
in models (compartimentalized)	0

formula

C₁₆H₁₈NO₃

charge

mass

272.12812

reference

chebi:58482

InChIKey

WZRCQWQRFZITDX-UHFFFAOYSA-O

InChI

InChI=1S/C16H17NO3/c18-12-3-1-10(2-4-12)7-14-13-9-16(20)15(19)8-11(13)5-6-17-14/h1-4,8-9,14,17-20H,5-7H2/p+1

SMILES

Oc1ccc(CC2[NH2+]CCc3cc(O)c(O)cc32)cc1

Parent-child relations graph

Deprecated MNXref IDs graph

Similar chemical compounds in external resources
Identifier	Description
CHEBI:58482 chebi:58482	norcoclaurine (RS)-norcoclaurinium (RS)-norcoclaurinium cation 6,7-dihydroxy-1-(4-hydroxybenzyl)-1,2,3,4-tetrahydroisoquinolinium
hmdb:HMDB0033103	(R)-Higenamine (+)-Demethylcoclaurine (+-)-1,2,3,4-Tetrahydro-1-((4-hydroxyphenyl)methyl)-6,7-isoquinolinediol (+-)-Demethylcoclaurine (+-)-Norcoclaurine (+-)-O-Demethylcoclaurine (R)-Norcoclaurine (R,S)-Norcoclaurine 1(S)-Norcoclaurine 1-(p-Hydroxybenzyl)-6,7-dihydroxy-1,2,3,4-tetrahydroisoquinoline 1-[(4-hydroxyphenyl)methyl]-1,2,3,4-tetrahydroisoquinoline-6,7-diol 6,7-Dihydroxy-1-[(4-hydroxyphenyl)methyl]-1,2,3,4-tetrahydroisoquinoline Higenamine Higenamine hydrobromide, (+-)-isomer Higenamine hydrochloride, (S)-isomer Higenamine oxalate (1:1), (+-)-isomer Higenamine, tartrate (1:1), R-(r,r)-(+-)-isomer Norcoclaurine O-Demethylcoclaurine higenamine
sabiork.compound:8564 sabiorkM:8564	(R,S)-Norcoclaurine 6,7-Dihydroxy-1-[(4-hydroxyphenyl)methyl]-1,2,3,4- tetrahydroisoquinoline 6,7-Dihydroxy-1-[(4-hydroxyphenyl)methyl]-1,2,3,4-tetrahydroisoquinoline Norcoclaurine
kegg.compound:C06346 keggC:C06346	(R,S)-Norcoclaurine 6,7-Dihydroxy-1-[(4-hydroxyphenyl)methyl]-1,2,3,4-tetrahydroisoquinoline Higenamine Norcoclaurine
CHEBI:18418 chebi:18418	(RS)-norcoclaurine (+-)-1,2,3,4-Tetrahydro-1-((4-hydroxyphenyl)methyl)-6,7-isoquinolinediol (+-)-Demethylcoclaurine (+-)-Norcoclaurine (+-)-O-Demethylcoclaurine (R,S)-Norcoclaurine 1-(4-hydroxybenzyl)-1,2,3,4-tetrahydroisoquinoline-6,7-diol 6,7-Dihydroxy-1-[(4-hydroxyphenyl)methyl]-1,2,3,4-tetrahydroisoquinoline Higenamine Norcoclaurine
metacyc.compound:CPD-21764 metacycM:CPD-21764	norcoclaurine 1,2,3,4-tetrahydro-1-[(4-hydroxyphenyl)methyl]-6,7-isoquinolinediol
hmdb:HMDB33103 chebi:11021 chebi:18714 chebi:361 keggC:M_C06346	secondary/obsolete/fantasy identifier