Reserpine

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Systematic / IUPAC Name: Methyl 11,17-dimethoxy-18-[(3,4,5-trimethoxybenzoyl)oxy]yohimban-16-carboxylate

ID: Reference941

Other Names: (-)-Reserpine;
Alkarau;
Alserin;
Apoplon;
Apsical ; more

Formula: C33H40N2O9

Class: Therapeutics/Prescription Drugs Endogenous Metabolites Natural Products/Medicines

Spectral Data

Reserpine mass spectral data can be found in a separate interface. The data are manually curated and of the highest quality.

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Available MS Data

Used Instruments LTQ Orbitrap XL; Orbitrap Elite; Q Exactive HF Orbitrap; Q Exactive Orbitrap
No. of Spectral Trees 8
No. of Spectra 5063
Tandem Spectra MS1, MS2, MS3, MS4, MS5
Ionization Methods ESI; NSI
Analyzers IT; FT
Last Modification 1/20/2017 10:34:51 AM
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Identificators

InChI InChI=1S/C33H40N2O9/c1-38-19-7-8-20-21-9-10-35-16-18-13-27(44-32(36)17-11-25(39-2)30(41-4)26(12-17)40-3)31(42-5)28(33(37)43-6)22(18)15-24(35)29(21)34-23(20)14-19/h7-8,11-12,14,18,22,24,27-28,31,34H,9-10,13,15-16H2,1-6H3/t18-,22+,24-,27-,28+,31+/m1/s1
InChI Key QEVHRUUCFGRFIF-MDEJGZGSSA-N
Canonical SMILES COC1C(CC2CN3CCC4=C(C3CC2C1C(=O)OC)NC5=C4C=CC(=C5)OC)OC(=O)C6=CC(=C(C(=C6)OC)OC)OC
CAS 50555
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Other Names (-)-Reserpine;
Alkarau;
Alserin;
Apoplon;
Apsical;
Ascoserpina;
Austrapine;
Banasil;
Benazyl;
Bioserpine;
Broserpine;
Carditivo;
Carpacil;
Carrserp;
Chloroserpine;
Crystoserpine;
Demi-regroton;
Deserpine;
Diupres;
Diupres;
Diures;
Diutensen-R;
Dralserp;
Eberpine;
Eberspine;
Elserpine;
Enipresser;
Escaspere;
Eserpine;
Eskaserp;
Eskaserpine;
Gammaserpine;
Gilucard;
Helfoserpin;
Hiposerpil;
Hiserpia;
Hydrap;
Hydromo;
Hydropine;
Hydropres;
Hydroserp;
Hydroserpalan;
Hydrosine;
Hypersil;
Hypersine;
Idoserp;
Idsoserp;
Interpina;
Kitine;
Klimanosid;
L-Carpserp;
Lemiserp;
Loweserp;
Mallopress;
Maviserpin;
Mayserpine;
Mephaserpin;
Naquival;
Neo-antitensol;
Neoserfin;
Neoserp;
Novoreserpine;
Pressimedin;
Purserpine;
Quiescin;
Raucap;
Raudiford;
Raudixoid;
Raugal;
Raulen;
Rauloydin;
Raumorine;
Raunervil;
Raunorine;
Raupasil;
Raupoid;
Raurine;
Rausan;
Rau-sed;
Rausedan;
Rausedil;
Rausedyl;
Rauserpine;
Rauserpol;
Rausingle;
Rautrin;
Rauvlid;
Rauwasedin;
Rauwilid;
Rauwipur;
Rauwita;
Rauwoleaf;
Rawilid;
Recipin;
Regroton;
Renese;
Resaltex;
Resedrex;
Resedril;
Reser-ar;
Reserbal;
Resercaps;
Resercen;
Reserfia;
Reserjen;
Reserlor;
Reserp;
Reserpal;
Reserpamed;
Reserpanca;
Reserpene;
Reserpex;
Reserpidefe;
Reserpil;
Reserpin;
Reserpina;
Reserpinum;
Reserpka;
Reserpoid;
Reserpur;
Resiatric;
Residin;
Residine;
Resine;
Resocalm;
Resperine;
Respital;
Restran;
Rezerpin;
Riserpa;
Rivased;
Rivasin;
Rolserp;
Roxel;
Roxinoid;
Roxynoid;
Ryser;
Salutensin-demi;
Sandril;
Sandron;
Sedaraupin;
Sedaraupina;
Sederaupin;
Sedserp;
Serfin;
Serfolia;
Serolfia;
Serpalan;
Serpaloid;
Serpaneurona;
Serpanray;
Serpasil;
Serpasil;
Serpasol;
Serpate;
Serpazil;
Serpedin;
Serpen;
Serpena;
Serpentil;
Serpentin;
Serpentina;
Serpicon;
Serpil;
Serpiloid;
Serpine;
Serpipur;
Serpivate;
Serpivite;
Serpogen;
Serpoid;
Serpone;
Serpyrit;
Sertabs;
Sertens;
Sertensin;
Sertina;
Tefaserpina;
Temposerpine;
Tenserpinie;
Tepserpine;
Triserpin;
T-Serp;
Unilord;
Vio-serpine;
(3β,16β,17α,18β,20α)-11,17-Dimethoxy-18-[(3,4,5-trimethoxybenzoyl)oxy]yohimban-16-carboxylic acid methyl ester;
11,17-Dimethoxy-18-((3,4,5-trimethoxybenzoyl)oxy)yohimban-16-carboxylic acid methyl ester;
Methyl (3β,16β,17α,18β,20α)-11,17-bis(methyloxy)-18-({[3,4,5-tris(methyloxy)phenyl]carbonyl}oxy)yohimban-16-carboxylate;
Methyl reserpate 3,4,5-trimethoxybenzoic acid ester;
Methylreserpate 3,4,5-trimethoxybenzoic acid;
Serpazol;
Yohimban-16-carboxylic acid, 11,17-dimethoxy-18-((3,4,5-trimethoxybenzoyl)oxy)-, methyl ester, (3β,16β,17α,18β,20α)-

In Other Databases

ChemSpider 5566
HMDb HMDB14351
ChEBI CHEBI:28487
Wikipedia Reserpine
KEGG C06539; D00197
PubChem 5770
ChEMBL CHEMBL772
DrugBank APRD00472
ChemIDPlus 000050555; 055128933; 078329756