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CHEBI:135927 - epicriptine

ChEBI IDCHEBI:135927
ChEBI Nameepicriptine
Stars
Last Modified23 February 2017
DownloadsMolfile
FormulaC32H43N5O5
Net Charge0
Average Mass577.726
Monoisotopic Mass577.32642
SMILES[H][C@@]12Cc3cnc4cccc(c34)[C@@]1([H])C[C@@H](C(=O)N[C@]1(C(C)C)O[C@]3(O)N(C1=O)[C@@]([H])([C@H](C)CC)C(=O)N1CCC[C@]13[H])CN2C
InChIInChI=1S/C32H43N5O5/c1-6-18(4)27-29(39)36-12-8-11-25(36)32(41)37(27)30(40)31(42-32,17(2)3)34-28(38)20-13-22-21-9-7-10-23-26(21)19(15-33-23)14-24(22)35(5)16-20/h7,9-10,15,17-18,20,22,24-25,27,33,41H,6,8,11-14,16H2,1-5H3,(H,34,38)/t18-,20-,22-,24-,25+,27+,31-,32+/m1/s1
InChIKeySBFXHXZNBNFPHV-PXXBSISHSA-N
Roles Classification
Biological Role:
metabolite  Any intermediate or product resulting from metabolism. The term 'metabolite' subsumes the classes commonly known as primary and secondary metabolites.
ChEBI Ontology
Outgoing Relation(s)
epicriptine (CHEBI:135927) is a peptide ergot alkaloid (CHEBI:25904)
Synonyms  Source
dihydro-beta-ergocryptinDrugCentral
dihydro-beta-ergocryptineDrugCentral
beta-dihydroergocryptineDrugCentral
Dihydro-.beta.-ergocryptine mesylateDrugCentral
Dihydro-.beta.-ergocryptine mesilateDrugCentral
Manual XrefsDatabases
4148DrugCentral
Registry NumbersSources
CAS:88660-47-3DrugCentral