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CHEBI:219168 - Nosperin

ChEBI IDCHEBI:219168
ChEBI NameNosperin
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SubmitterMetaboLights
DownloadsMolfile
FormulaC26H43N3O9
Net Charge0
Average Mass541.642
Monoisotopic Mass541.29993
SMILESC=C1C[C@](OC)([C@@H](O)C(=O)N/C=C/C(CO)[C@@H](O)C(C)C(=O)N2CCC[C@H]2[C@H](O)CC(N)=O)O[C@H](C)[C@@H]1C
InChIInChI=1S/C26H43N3O9/c1-14-12-26(37-5,38-17(4)15(14)2)23(34)24(35)28-9-8-18(13-30)22(33)16(3)25(36)29-10-6-7-19(29)20(31)11-21(27)32/h8-9,15-20,22-23,30-31,33-34H,1,6-7,10-13H2,2-5H3,(H2,27,32)(H,28,35)/b9-8+/t15-,16?,17-,18?,19+,20-,22+,23+,26-/m1/s1
InChIKeyAYSMYLUVPGMSKV-UOWHAGKMSA-N
Species of MetaboliteComponentSourceComments
Nostoc (ncbitaxon:1177) - PubMed (23898213)
ChEBI Ontology
Outgoing Relation(s)
Nosperin (CHEBI:219168) is a N-acylpyrrolidine (CHEBI:46766)
IUPAC Name 
(3R)-3-hydroxy-3-[(2S)-1-[(E,3R)-3-hydroxy-6-[[(2R)-2-hydroxy-2-[(2R,5R,6R)-2-methoxy-5,6-dimethyl-4-methylideneoxan-2-yl]acetyl]amino]-4-(hydroxymethyl)-2-methylhex-5-enoyl]pyrrolidin-2-yl]propanamide
Manual XrefsDatabases
78440515ChemSpider