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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: | apoptosis inducer Any substance that induces the process of apoptosis (programmed cell death) in multi-celled organisms. antifungal agent An antimicrobial agent that destroys fungi by suppressing their ability to grow or reproduce. |
| 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 |
|---|---|
| solasodinium | ChEBI |
| (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 |
| UniProt Name | Source |
|---|---|
| solasodine | UniProt |
| Citations |
|---|