loading...| Preferred Name |
deserpidine |
|
| Synonyms |
Raunormine Harmonyl (3beta,16beta,17alpha,18beta,20alpha)-17-methoxy-18-[(3,4,5-trimethoxybenzoyl)oxy]yohimban-16-carboxylic acid methyl ester 11-desmethoxyreserpine 11-demethoxyreserpine recanescine canescine methyl (3beta,16beta,17alpha,18beta,20alpha)-17-methoxy-18-[(3,4,5-trimethoxybenzoyl)oxy]yohimban-16-carboxylate Deserpidine |
|
| ID |
http://purl.obolibrary.org/obo/CHEBI_27478 |
|
| alternative label |
Raunormine Harmonyl (3beta,16beta,17alpha,18beta,20alpha)-17-methoxy-18-[(3,4,5-trimethoxybenzoyl)oxy]yohimban-16-carboxylic acid methyl ester 11-desmethoxyreserpine 11-demethoxyreserpine recanescine canescine methyl (3beta,16beta,17alpha,18beta,20alpha)-17-methoxy-18-[(3,4,5-trimethoxybenzoyl)oxy]yohimban-16-carboxylate Deserpidine |
|
| charge |
0 |
|
| database_cross_reference |
Drug_Central:810 Beilstein:101820 KNApSAcK:C00001712 KEGG:D08194 DrugBank:DB01089 CAS:131-01-1 KEGG:C06541 Wikipedia:Deserpidine |
|
| formula |
C32H38N2O8 |
|
| has exact synonym |
methyl (3beta,16beta,17alpha,18beta,20alpha)-17-methoxy-18-[(3,4,5-trimethoxybenzoyl)oxy]yohimban-16-carboxylate Deserpidine |
|
| has parent hydride | ||
| has_alternative_id |
CHEBI:4444 CHEBI:23645 |
|
| has_obo_namespace |
chebi_ontology |
|
| has_related_synonym |
Raunormine Harmonyl (3beta,16beta,17alpha,18beta,20alpha)-17-methoxy-18-[(3,4,5-trimethoxybenzoyl)oxy]yohimban-16-carboxylic acid methyl ester 11-desmethoxyreserpine 11-demethoxyreserpine recanescine canescine |
|
| id |
CHEBI:27478 |
|
| in_subset | ||
| inchi |
InChI=1S/C32H38N2O8/c1-37-24-12-17(13-25(38-2)29(24)39-3)31(35)42-26-14-18-16-34-11-10-20-19-8-6-7-9-22(19)33-28(20)23(34)15-21(18)27(30(26)40-4)32(36)41-5/h6-9,12-13,18,21,23,26-27,30,33H,10-11,14-16H2,1-5H3/t18-,21+,23-,26-,27+,30+/m1/s1 |
|
| inchikey |
CVBMAZKKCSYWQR-WCGOZPBSSA-N |
|
| label |
deserpidine |
|
| mass |
578.65270 |
|
| monoisotopicmass |
578.26282 |
|
| notation |
CHEBI:27478 |
|
| preferred label |
deserpidine |
|
| prefLabel |
deserpidine |
|
| smiles |
CO[C@H]1[C@@H](C[C@@H]2CN3CCc4c([nH]c5ccccc45)[C@H]3C[C@@H]2[C@@H]1C(=O)OC)OC(=O)c1cc(OC)c(OC)c(OC)c1 |
|
| subClassOf |
http://purl.obolibrary.org/obo/CHEBI_38164 http://purl.obolibrary.org/obo/CHEBI_36054 http://purl.obolibrary.org/obo/CHEBI_27358 |