Compound Summary


  Compound Information
 Dihydro-beta-erythroidine hydrobromide

Compound Name:

Dihydro-beta-erythroidine hydrobromide

Compound CID:

11957537

Synonyms:

Dihydro-beta-erythroidine hydrobromide

29734-68-7

UNII-NS1U03GC05

MLS002172468

NS1U03GC05

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Iupac Name:

(1S,16S)-16-methoxy-5-oxa-10-azatetracyclo[8.7.0.01,13.02,7]heptadeca-2(7),13-dien-4-one;hydrobromide

InChI:

InChI=1S/C16H21NO3.BrH/c1-19-13-3-2-12-5-7-17-6-4-11-10-20-15(18)8-14(11)16(12,17)9-13;/h2,13H,3-10H2,1H3;1H/t13-,16-;/m0./s1

InChIKey:

GFIGWAJEIMHJJB-LINSIKMZSA-N

Canonical Smiles:

COC1CC=C2CCN3C2(C1)C4=C(CC3)COC(=O)C4.Br

Isomeric Smiles:

CO[C@H]1CC=C2CCN3[C@]2(C1)C4=C(CC3)COC(=O)C4.Br

Molecular Weight:

356.25

Molecular Formula:

C16H22BrNO3

  Compound Structure
 2D Structure:
 3D Structure:
  Computed Properties
 Dihydro-beta-erythroidine hydrobromide

Molecular Weight:

356.25

Molecular Formula:

C16H22BrNO3

Hydrogen Bond Donor Count:

1

Hydrogen Bond Acceptor Count:

4

Rotatable Bond Count:

1

Heavy Atom Count:

21

Complexity:

522

  Synonyms
 Dihydro-beta-erythroidine hydrobromide

Dihydro-beta-erythroidine hydrobromide Dihydro-beta-erythroidine hydrobromide

Dihydro-beta-erythroidine hydrobromide

29734-68-7

UNII-NS1U03GC05

MLS002172468

NS1U03GC05

(1S,16S)-16-methoxy-5-oxa-10-azatetracyclo8.7.0.01,13.02,7heptadeca-2(7),13-dien-4-one;hydrobromide

Dihydro-beta-erythroidine (hydrobromide)

CHEMBL1319741

(2S,13bS)-2-Methoxy-2,3,5,6,8,9,10,13-octahydro-1H,12H-benzoipyrano3,4-gindolizin-12-one hydrobromide

1H,12H-Pyrano4,3:3,4pyrido2,1-iindol-12-one, 2,3,5,6,8,9,10,13-octahydro-2-methoxy-, hydrobromide (1:1), (2S,13bS)-

Dihydro-beta-erythroidine hydrogen bromide

DH?E

EU-0100468

beta-ERYTHROIDINE, DIHYDRO-, HYDROBROMIDE

SCHEMBL1320306

DTXSID80952179

CHEBI:182188

Dihydro-b-erythroidine hydrobromide

Dihydro-?-erythroidine hydrobromide

Tox21_500468

AKOS024457064

LP00468

NCGC00093880-01

NCGC00261153-01

BD162627

SMR001254098

HY-107670

CS-0029149

Q27285025

3beta-1,6-Didehydro-14,17-dihydro-3-methoxy-16(15H)-oxaerythrinan-15-one hydrobromide

(2S,13BS)-2-METHOXY-2,3,5,6,8,9,10,13-OCTAHYDRO-1H,12H-BENZOIPYRANO3,4-GINDOLIZIN-12-ONEHYDROBROMIDE

  Experimental Data
 Dihydro-beta-erythroidine hydrobromide

Species Dosage Unit CG Lifespan(AVG/MED days) TG Lifespan(AVG/MED days) Lifespan Change(AVG/MED%) CG Lifespan(MAX days) TG Lifespan(MAX days) Lifespan Change(MAX%) Significant Strain Gender PubMed Active Label
Caenorhabditis elegans 33 umol/L 13 NS N2 24134630 Inactive
  Experimental Data Visualization
 Dihydro-beta-erythroidine hydrobromide

  Statistics Data
 Dihydro-beta-erythroidine hydrobromide

Species Lifespan Change(AVG/MED%) Lifespan Change(MAX%) Count Reference Count Data point
Caenorhabditis elegans 13 1 1
  Statistics Data Visualization
 Dihydro-beta-erythroidine hydrobromide