CHEBI:145043 - solasodine(1+)

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ChEBI Name solasodine(1+)
ChEBI ID CHEBI:145043
Definition A secondary ammonium ion resulting from the protonation of the amino group of solasodine. The major species at pH 7.3.
Stars This entity has been manually annotated by the ChEBI Team.
Submitter Kristian Axelsen
Supplier Information
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Formula C27H44NO2
Net Charge +1
Average Mass 414.653
Monoisotopic Mass 414.33666
InChI InChI=1S/C27H43NO2/c1-16-7-12-27(28-15-16)17(2)24-23(30-27)14-22-20-6-5-18-13-19(29)8-10-25(18,3)21(20)9-11-26(22,24)4/h5,16-17,19-24,28-29H,6-15H2,1-4H3/p+1/t16-,17+,19+,20-,21+,22+,23+,24+,25+,26+,27-/m1/s1
InChIKey KWVISVAMQJWJSZ-VKROHFNGSA-O
SMILES [C@]12([C@]3([C@@]([C@@]4(C(C[C@@H](O)CC4)=CC3)C)(CC[C@]2(C)[C@]5([C@@H]([C@]6(O[C@]5(C1)[H])CC[C@@H](C)C[NH2+]6)C)[H])[H])[H])[H]
Roles Classification
Chemical Role(s): antioxidant
A substance that opposes oxidation or inhibits reactions brought about by dioxygen or peroxides.
Biological Role(s): antifungal agent
An antimicrobial agent that destroys fungi by suppressing their ability to grow or reproduce.
apoptosis inducer
Any substance that induces the process of apoptosis (programmed cell death) in multi-celled organisms.
Application(s): antineoplastic agent
A substance that inhibits or prevents the proliferation of neoplasms.
anticonvulsant
A drug used to prevent seizures or reduce their severity.
antiinfective agent
A substance used in the prophylaxis or therapy of infectious diseases.
antipyretic
A drug that prevents or reduces fever by lowering the body temperature from a raised state. An antipyretic will not affect the normal body temperature if one does not have fever. Antipyretics cause the hypothalamus to override an interleukin-induced increase in temperature. The body will then work to lower the temperature and the result is a reduction in fever.
antispermatogenic agent
An agent that destroy spermatozoa in the male genitalia and block spermatogenesis.
View more via ChEBI Ontology
ChEBI Ontology
Outgoing solasodine(1+) (CHEBI:145043) has role anticonvulsant (CHEBI:35623)
solasodine(1+) (CHEBI:145043) has role antifungal agent (CHEBI:35718)
solasodine(1+) (CHEBI:145043) has role antiinfective agent (CHEBI:35441)
solasodine(1+) (CHEBI:145043) has role antineoplastic agent (CHEBI:35610)
solasodine(1+) (CHEBI:145043) has role antioxidant (CHEBI:22586)
solasodine(1+) (CHEBI:145043) has role antipyretic (CHEBI:35493)
solasodine(1+) (CHEBI:145043) has role antispermatogenic agent (CHEBI:145047)
solasodine(1+) (CHEBI:145043) has role apoptosis inducer (CHEBI:68495)
solasodine(1+) (CHEBI:145043) is a secondary ammonium ion (CHEBI:137419)
solasodine(1+) (CHEBI:145043) is conjugate acid of solasodine (CHEBI:9190)
Incoming solasodine (CHEBI:9190) is conjugate base of solasodine(1+) (CHEBI:145043)
IUPAC Name
(25R)-3β-hydroxy-22α-spirosol-5-en-28-ium
Synonyms Sources
(2S,2'R,4aR,4bS,5'R,6aS,6bR,7S,9aS,10aS,10bS)-2-hydroxy-4a,5',6a,7-tetramethyl-1,2,3,4,4a,4b,5,6,6a,6b,7,9a,10,10a,10b,11-hexadecahydrospiro[naphtho[2',1':4,5]indeno[2,1-b]furan-8,2'-piperidinium] IUPAC
solasod-5-en-3β-ol(1+) ChEBI
solasodine UniProt
solasodinium ChEBI
Citation Waiting for Citations Type Source
25888493 PubMed citation SUBMITTER
Last Modified
08 October 2019