CHEBI:9188 - solanine

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ChEBI Name solanine
ChEBI ID CHEBI:9188
Definition A glycoalkaloid poison found in species of the nightshade family (Solanaceae), such as the potato (Solanum tuberosum). It is a trisccharide derivative of solanidine [(22β)-solanid-5-en-3β-ol].
Stars This entity has been manually annotated by the ChEBI Team.
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Formula C45H73NO15
Net Charge 0
Average Mass 868.05880
Monoisotopic Mass 867.498
InChI InChI=1S/C45H73NO15/c1-19-6-9-27-20(2)31-28(46(27)16-19)15-26-24-8-7-22-14-23(10-12-44(22,4)25(24)11-13-45(26,31)5)57-43-40(61-41-37(54)35(52)32(49)21(3)56-41)39(34(51)30(18-48)59-43)60-42-38(55)36(53)33(50)29(17-47)58-42/h7,19-21,23-43,47-55H,6,8-18H2,1-5H3/t19-,20+,21-,23-,24+,25-,26-,27+,28-,29+,30+,31-,32-,33+,34-,35+,36-,37+,38+,39-,40+,41-,42-,43+,44-,45-/m0/s1
InChIKey ZGVSETXHNHBTRK-UDJLNJFBSA-N
SMILES C[C@@H]1[C@H]2CC[C@H](C)CN2[C@H]2C[C@H]3[C@@H]4CC=C5C[C@H](CC[C@]5(C)[C@H]4CC[C@]3(C)[C@@H]12)O[C@@H]1O[C@H](CO)[C@H](O)[C@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@H]1O[C@@H]1O[C@@H](C)[C@H](O)[C@@H](O)[C@H]1O
Roles Classification
Biological Role(s): phytotoxin
Any toxin produced by a plant.
apoptosis inducer
Any substance that induces the process of apoptosis (programmed cell death) in multi-celled organisms.
plant metabolite
Any eukaryotic metabolite produced during a metabolic reaction in plants, the kingdom that include flowering plants, conifers and other gymnosperms.
metabolite
Any intermediate or product resulting from metabolism. The term 'metabolite' subsumes the classes commonly known as primary and secondary metabolites.
(via saponin )
Application(s): antineoplastic agent
A substance that inhibits or prevents the proliferation of neoplasms.
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ChEBI Ontology
Outgoing solanine (CHEBI:9188) has functional parent solanidine (CHEBI:28374)
solanine (CHEBI:9188) has role antineoplastic agent (CHEBI:35610)
solanine (CHEBI:9188) has role apoptosis inducer (CHEBI:68495)
solanine (CHEBI:9188) has role phytotoxin (CHEBI:38231)
solanine (CHEBI:9188) has role plant metabolite (CHEBI:76924)
solanine (CHEBI:9188) is a organic heterohexacyclic compound (CHEBI:51914)
solanine (CHEBI:9188) is a steroid saponin (CHEBI:61655)
solanine (CHEBI:9188) is a trisaccharide derivative (CHEBI:63571)
IUPAC Name
solanid-5-en-3β-yl 6-deoxy-α-L-mannopyranosyl-(1→2)-[β-D-glucopyranosyl-(1→3)]-β-D-galactopyranoside
Synonyms Sources
alpha-Solanin ChemIDplus
α-solanine ChEBI
Solanine KEGG COMPOUND
Database Links Databases
C00002262 KNApSAcK
C10820 KEGG COMPOUND
CPD-9211 MetaCyc
HMDB0034202 HMDB
LSM-3583 LINCS
Solanine Wikipedia
View more database links
Registry Numbers Types Sources
20562-02-1 CAS Registry Number ChemIDplus
77607 Reaxys Registry Number Reaxys
77607 Beilstein Registry Number ChemIDplus
Citations Waiting for Citations Types Sources
18022776 PubMed citation Europe PMC
21485553 PubMed citation Europe PMC
23411230 PubMed citation Europe PMC
23454444 PubMed citation Europe PMC
23473422 PubMed citation Europe PMC
23494897 PubMed citation Europe PMC
23790833 PubMed citation Europe PMC
23954587 PubMed citation Europe PMC
24051269 PubMed citation Europe PMC
Last Modified
25 February 2016