IngredientID 34280

Sympamin

C9H13N

Relationship Network

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Herb: 1Ingredient: 1Target: 12Links: 13

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Record Fields

Scalar fields from the final ingredient record.

Ingredient Id: 34280
Core Entity Id: 41298
Source Entity Count: 1
Preferred Name: Sympamin
Name En
Pubchem Id: 5826
Smiles Canonical: CC(CC1=CC=CC=C1)N
Molecular Formula: C9H13N
Molecular Weight: 135.2100
Inchikey: KWTSXDURSIMDCE-QMMMGPOBSA-N
Inchi: InChI=1S/C9H13N/c1-8(10)7-9-5-3-2-4-6-9/h2-6,8H,7,10H2,1H3/t8-/m0/s1
Isomeric Smiles: C[C@@H](CC1=CC=CC=C1)N
Cas Id: 51-64-9
Ob Score: 44.8477
Mol Logp: 1.5763
Num H Donors: 1
Num H Acceptors: 1
Num Rotatable Bonds: 2
Drug Likeness: 0.6540
Polar Surface Area
Molecular Volume
Alogp

Names

Preferred names, aliases, and source labels retained in the final schema.

Name

Sympamin

Role

Molecule_name

Source

SymMap_v2

Preferred

Yes

Name

Sympamin

Role

preferred

Source

ETCM_v2

Preferred

Yes

Name

Sympamin

Role

preferred

Source

itcmdb_public

Preferred

Yes

Name

Sympamin

Role

preferred

Source

TCMBank

Preferred

Yes

Name

Sympamin

Role

preferred

Source

SymMap_v2

Preferred

Yes

Name

Sympamin

Role

preferred

Source

HERB_v2

Preferred

Yes

Name

(+)-(S)-Amphetamine

Role

alias

Source

TCMBank

Preferred

Name

(+)-Amphetamine

Role

alias

Source

itcmdb_public

Preferred

Name

(+)-Amphetamine

Role

alias

Source

HERB_v2

Preferred

Name

(+)-Phenaminum

Role

alias

Source

TCMBank

Preferred

Name

(+)-alpha-Methylphenethylamine

Role

alias

Source

TCMBank

Preferred

Name

(+)-alpha-Methylphenylethylamine

Role

alias

Source

TCMBank

Preferred

Name

(2S)-(+)-Amphetamine

Role

alias

Source

TCMBank

Preferred

Name

(2S)-1-phenylpropan-2-amine

Role

alias

Source

TCMBank

Preferred

Name

(S)-(+)-beta-Phenylisopropylamine

Role

alias

Source

TCMBank

Preferred

Name

(S)-1-Phenyl-2-aminopropane

Role

alias

Source

TCMBank

Preferred

Name

(S)-1-Phenyl-2-propanamine

Role

alias

Source

TCMBank

Preferred

Name

(S)-1-Phenyl-2-propylamine

Role

alias

Source

TCMBank

Preferred

Name

(S)-Amphetamine

Role

alias

Source

itcmdb_public

Preferred

Name

(S)-Amphetamine

Role

alias

Source

HERB_v2

Preferred

Name

(S)-alpha-Methylphenethylamine

Role

alias

Source

TCMBank

Preferred

Name

(S)-alpha-Phenylethylamine

Role

alias

Source

TCMBank

Preferred

Name

(S)-alpha-methylbenzeneethanamine

Role

alias

Source

TCMBank

Preferred

Name

(alphaS)-alpha-methylbenzeneethanamine

Role

alias

Source

TCMBank

Preferred

Name

4-12-00-02587 (Beilstein Handbook Reference)

Role

alias

Source

TCMBank

Preferred

Name

51-64-9

Role

alias

Source

TCMBank

Preferred

Name

51-64-9

Role

alias

Source

itcmdb_public

Preferred

Name

51-64-9

Role

alias

Source

HERB_v2

Preferred

Name

BRN 2205872

Role

alias

Source

TCMBank

Preferred

Name

Benzeneethanamine, alpha-methyl-, (S)-

Role

alias

Source

TCMBank

Preferred

Name

Benzeneethanamine, alpha-methyl-, (aS)- (9CI)

Role

alias

Source

TCMBank

Preferred

Name

Benzeneethanamine, alpha-methyl-, (alphaS)-

Role

alias

Source

TCMBank

Preferred

Name

C07884

Role

alias

Source

TCMBank

Preferred

Name

CHEBI:4469

Role

alias

Source

TCMBank

Preferred

Name

D-(+)-Amphetamine

Role

alias

Source

TCMBank

Preferred

Name

D-Amphetamine

Role

alias

Source

itcmdb_public

Preferred

Name

D-Amphetamine

Role

alias

Source

HERB_v2

Preferred

Name

D03740

Role

alias

Source

TCMBank

Preferred

Name

DEA No. 1100

Role

alias

Source

TCMBank

Preferred

Name

Desamfetamina

Role

alias

Source

TCMBank

Preferred

Name

Desamfetamina [DCIT]

Role

alias

Source

TCMBank

Preferred

Name

Dexadrine

Role

alias

Source

TCMBank

Preferred

Name

Dexamfetamina [INN-Spanish]

Role

alias

Source

TCMBank

Preferred

Name

Dexamfetamine

Role

alias

Source

itcmdb_public

Preferred

Name

Dexamfetamine

Role

alias

Source

TCMBank

Preferred

Name

Dexamfetamine

Role

alias

Source

HERB_v2

Preferred

Name

Dexamfetamine (INN)

Role

alias

Source

TCMBank

Preferred

Name

Dexamfetaminum [INN-Latin]

Role

alias

Source

TCMBank

Preferred

Name

Dexamphetamine

Role

alias

Source

HERB_v2

Preferred

Name

Dexamphetamine

Role

alias

Source

itcmdb_public

Preferred

Name

Dexamphetaminum [INN-Latin]

Role

alias

Source

TCMBank

Preferred

Name

Dexanfetamina [INN-Spanish]

Role

alias

Source

TCMBank

Preferred

Name

Dexidrine

Role

alias

Source

TCMBank

Preferred

Name

Dextroamphetamine

Role

alias

Source

HERB_v2

Preferred

Name

Dextroamphetamine

Role

alias

Source

TCMBank

Preferred

Name

Dextroamphetamine

Role

alias

Source

itcmdb_public

Preferred

Name

Dextroamphetamine [USAN]

Role

alias

Source

TCMBank

Preferred

Name

EINECS 200-112-1

Role

alias

Source

TCMBank

Preferred

Name

HSDB 3055

Role

alias

Source

TCMBank

Preferred

Name

NSC 73713

Role

alias

Source

TCMBank

Preferred

Name

PDSP1_001511

Role

alias

Source

TCMBank

Preferred

Name

PDSP2_001495

Role

alias

Source

TCMBank

Preferred

Name

Phenethylamine, alpha-methyl-, (+)-

Role

alias

Source

TCMBank

Preferred

Name

Phenethylamine, alpha-methyl-, (+)- (8CI)

Role

alias

Source

TCMBank

Preferred

Name

Phenethylamine, alpha-methyl-, d-

Role

alias

Source

TCMBank

Preferred

Name

TZ47U051FI

Role

alias

Source

HERB_v2

Preferred

Name

TZ47U051FI

Role

alias

Source

itcmdb_public

Preferred

Name

Xelstrym

Role

alias

Source

HERB_v2

Preferred

Name

Xelstrym

Role

alias

Source

itcmdb_public

Preferred

Name

[(1S)-1-methyl-2-phenyl-ethyl]amine

Role

alias

Source

TCMBank

Preferred

Name

alpha-Methylphenethylamine, d-form

Role

alias

Source

TCMBank

Preferred

Name

d-1-Phenyl-2-aminopropan [German]

Role

alias

Source

TCMBank

Preferred

Name

d-alpha-Methylphenethylamine

Role

alias

Source

TCMBank

Preferred

Name

Levamfetamine

Role

Molecule_name

Source

SymMap_v2

Preferred

Yes

Name

(-)-Amphetamine

Role

alias

Source

HERB_v2

Preferred

Name

(-)-Phenylisopropylamine

Role

alias

Source

TCMBank

Preferred

Name

(-)-alpha-Methylphenethylamine

Role

alias

Source

TCMBank

Preferred

Name

(2R)-1-phenylpropan-2-amine

Role

alias

Source

HERB_v2

Preferred

Name

(R)-1-Phenylpropan-2-amine

Role

alias

Source

itcmdb_public

Preferred

Name

(R)-Amphetamine

Role

alias

Source

HERB_v2

Preferred

Name

(R)-alpha-Methylbenzeneethanamine

Role

alias

Source

TCMBank

Preferred

Name

(R)-alpha-Methylphenethylamine

Role

alias

Source

TCMBank

Preferred

Name

156-34-3

Role

alias

Source

HERB_v2

Preferred

Name

Benzeneethanamine, alpha-methyl-, (R)- (9CI)

Role

alias

Source

TCMBank

Preferred

Name

CHEBI:42724

Role

alias

Source

TCMBank

Preferred

Name

EINECS 205-850-8

Role

alias

Source

TCMBank

Preferred

Name

L-Amphetamine

Role

alias

Source

itcmdb_public

Preferred

Name

Levamfetamina [DCIT]

Role

alias

Source

TCMBank

Preferred

Name

Levamfetaminum [INN-Latin]

Role

alias

Source

TCMBank

Preferred

Name

Levamphetamine

Role

alias

Source

HERB_v2

Preferred

Name

Levamphetaminum

Role

alias

Source

HERB_v2

Preferred

Name

Levanfetamina [INN-Spanish]

Role

alias

Source

TCMBank

Preferred

Name

PDSP1_001510

Role

alias

Source

TCMBank

Preferred

Name

PDSP2_001494

Role

alias

Source

TCMBank

Preferred

Name

Phenethylamine, alpha-methyl-, (-)-

Role

alias

Source

TCMBank

Preferred

Name

[(1R)-1-methyl-2-phenyl-ethyl]amine

Role

alias

Source

TCMBank

Preferred

Name

l-(R)-Amphetamine

Role

alias

Source

HERB_v2

Preferred

Name

l-alpha-Methylphenethylamine

Role

alias

Source

TCMBank

Preferred

Aliases

Additional names normalized into the restored final schema.

(+)-(S)-Amphetamine(+)-Amphetamine(+)-Phenaminum(+)-alpha-Methylphenethylamine(+)-alpha-Methylphenylethylamine(2S)-(+)-Amphetamine(2S)-1-phenylpropan-2-amine(S)-(+)-beta-Phenylisopropylamine(S)-1-Phenyl-2-aminopropane(S)-1-Phenyl-2-propanamine(S)-1-Phenyl-2-propylamine(S)-Amphetamine(S)-alpha-Methylphenethylamine(S)-alpha-Phenylethylamine(S)-alpha-methylbenzeneethanamine(alphaS)-alpha-methylbenzeneethanamine4-12-00-02587 (Beilstein Handbook Reference)51-64-9BRN 2205872Benzeneethanamine, alpha-methyl-, (S)-Benzeneethanamine, alpha-methyl-, (aS)- (9CI)Benzeneethanamine, alpha-methyl-, (alphaS)-C07884CHEBI:4469D-(+)-AmphetamineD-AmphetamineD03740DEA No. 1100DesamfetaminaDesamfetamina [DCIT]DexadrineDexamfetamina [INN-Spanish]DexamfetamineDexamfetamine (INN)Dexamfetaminum [INN-Latin]DexamphetamineDexamphetaminum [INN-Latin]Dexanfetamina [INN-Spanish]DexidrineDextroamphetamineDextroamphetamine [USAN]EINECS 200-112-1HSDB 3055NSC 73713PDSP1_001511PDSP2_001495Phenethylamine, alpha-methyl-, (+)-Phenethylamine, alpha-methyl-, (+)- (8CI)Phenethylamine, alpha-methyl-, d-TZ47U051FIXelstrym[(1S)-1-methyl-2-phenyl-ethyl]aminealpha-Methylphenethylamine, d-formd-1-Phenyl-2-aminopropan [German]d-alpha-MethylphenethylamineLevamfetamine(-)-Amphetamine(-)-Phenylisopropylamine(-)-alpha-Methylphenethylamine(2R)-1-phenylpropan-2-amine(R)-1-Phenylpropan-2-amine(R)-Amphetamine(R)-alpha-Methylbenzeneethanamine(R)-alpha-Methylphenethylamine156-34-3Benzeneethanamine, alpha-methyl-, (R)- (9CI)CHEBI:42724EINECS 205-850-8L-AmphetamineLevamfetamina [DCIT]Levamfetaminum [INN-Latin]LevamphetamineLevamphetaminumLevanfetamina [INN-Spanish]PDSP1_001510PDSP2_001494Phenethylamine, alpha-methyl-, (-)-[(1R)-1-methyl-2-phenyl-ethyl]aminel-(R)-Amphetaminel-alpha-Methylphenethylamine

Cross References

Trusted external identifiers retained for this final record.

Cas

51-64-9156-34-3

Herb

HBIN045216HBIN033035

Tcmsp

MOL004466MOL004467

Sym Map

SMIT06386SMIT06387

Pub Chem

582632893

Tcmbank

TCMBANKIN015846TCMBANKIN033980

Etcm Ingredient

Sympamin

Itcmdb Generated

ITX-INGREDIENT-DD63C59BA9ED

Attributes

Merged source attributes and domain-specific metadata.

Type

Other ingredients

In Ch I

InChI=1S/C9H13N/c1-8(10)7-9-5-3-2-4-6-9/h2-6,8H,7,10H2,1H3/t8-/m0/s1

Mol Wt

135.21

Cas Id

51-64-9

Smiles

CC(CC1=CC=CC=C1)N

Mol Log P

1.5763

Version

v1,v2

In Ch Ikey

KWTSXDURSIMDCE-QMMMGPOBSA-N

Ob Score

44.847681944.84768244.848

Suppress

Num Hdonors

Drug Likeness

0.654

Num Hacceptors

Isomeric Smiles

C[C@@H](CC1=CC=CC=C1)N

Molecule Weight

135.23

Canonical Smiles

CC(CC1=CC=CC=C1)N

Herb Alias Names

(+)-Amphetamine(S)-Amphetamine51-64-9D-AmphetamineDextroamphetamineTZ47U051FIXelstrymDexamphetamineDexamfetamine(+)-(S)-Amphetamine

Molecular Weight

135.100

Molecular Weight

135.21

Molecular Formula

C9H13N

Molecular Formula

C9H13N

Molecular Formula

C9H13N

Num Rotatable Bonds

Fda Maximum Daily Dose (Fdamdd)

0.710

Quantitative Estimate Of Drug Likeness（Qed）

0.654