CHEBI:5941 - intermedine

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name intermedine
ChEBI ID CHEBI:5941
Definition A carboxylic ester compound formed from condensation between retronecine and (2S,3R)-2,3-dihydroxy-2-isopropylbutanoic acid.
Stars This entity has been manually annotated by the ChEBI Team.
Supplier Information
Download Molfile XML SDF
Formula C15H25NO5
Net Charge 0
Average Mass 299.36270
Monoisotopic Mass 299.17327
InChI InChI=1S/C15H25NO5/c1-9(2)15(20,10(3)17)14(19)21-8-11-4-6-16-7-5-12(18)13(11)16/h4,9-10,12-13,17-18,20H,5-8H2,1-3H3/t10-,12-,13-,15+/m1/s1
InChIKey SFVVQRJOGUKCEG-OPQSFPLASA-N
SMILES [H][C@@]12[C@H](O)CCN1CC=C2COC(=O)[C@](O)(C(C)C)[C@@H](C)O
ChEBI Ontology
Outgoing intermedine (CHEBI:5941) is a azabicycloalkane (CHEBI:38295)
intermedine (CHEBI:5941) is a carboxylic ester (CHEBI:33308)
intermedine (CHEBI:5941) is a pyrrolizines (CHEBI:38522)
IUPAC Name
[(1R,7aR)-1-hydroxy-2,3,5,7a-tetrahydro-1H-pyrrolo[1,2-a]pyrrol-7-yl]methyl (2S,3R)-2,3-dihydroxy-2-isopropylbutanoate
INNs Sources
Intermedina ChEBI
Intermedinum ChEBI
Synonyms Sources
9-(+)-Trachelanthylretronecine KEGG COMPOUND
beta-MSH ChemIDplus
Intermedine KEGG COMPOUND
Manual Xrefs Databases
C00002093 KNApSAcK
C10330 KEGG COMPOUND
View more database links
Registry Numbers Types Sources
10285-06-0 CAS Registry Number KEGG COMPOUND
10285-06-0 CAS Registry Number ChemIDplus
3594490 Beilstein Registry Number Beilstein
Last Modified
28 July 2014