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CHEBI:145043 - solasodine(1+)
| Formula | C27H44NO2 |
| Net Charge | +1 |
| Average Mass | 414.654 |
| Monoisotopic Mass | 414.33666 |
| SMILES | [H][C@@]12CC=C3C[C@@H](O)CC[C@]3(C)[C@@]1([H])CC[C@@]1(C)[C@@]2([H])C[C@]2([H])O[C@]3(CC[C@@H](C)C[NH2+]3)[C@@H](C)[C@]12[H] |
| 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 |
| Roles Classification |
|---|
| Chemical Role: | antioxidant A substance that opposes oxidation or inhibits reactions brought about by dioxygen or peroxides. |
| Biological Roles: | 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. |
| Applications: | 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. antineoplastic agent A substance that inhibits or prevents the proliferation of neoplasms. antiinfective agent A substance used in the prophylaxis or therapy of infectious diseases. anticonvulsant A drug used to prevent seizures or reduce their severity. |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| 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 Relation(s) |
| solasodine (CHEBI:9190) is conjugate base of solasodine(1+) (CHEBI:145043) |
| IUPAC Name |
|---|
| (25R)-3β-hydroxy-22α-spirosol-5-en-28-ium |
| Synonyms | Source |
|---|---|
| (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 |
| solasodinium | ChEBI |
| UniProt Name | Source |
|---|---|
| solasodine | UniProt |
| Citations |
|---|