solasodine
An oxaspiro compound and steroid alkaloid sapogenin with formula C27H43NO2 found in the Solanum (nightshade) family. It is used as a precursor in the synthesis of complex steroidal compounds such as contraceptive pills.
Machine-generated and unreviewed. Identity, structure and cross-references come straight from ChEBI's and CARD's own data; no curator has signed off on this record yet.
Classification
-
CHEBI:141498 -
CHEBI:26606 -
CHEBI:26767 -
CHEBI:35624 -
CHEBI:37948 - alkaloid antibiotic
CHEBI:86322
Chemical structure
| Molecular formula | C27H43NO2 |
|---|---|
| Charge | 0 |
| Average mass | 413.646 Da |
| Monoisotopic mass | 413.32938 Da |
| Source | ChEBI |
| InChIKey | KWVISVAMQJWJSZ-VKROHFNGSA-N |
[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)CN3)[C@@H](C)[C@]12[H]
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/t16-,17+,19+,20-,21+,22+,23+,24+,25+,26+,27-/m1/s1
Also called
- (25R)-22α-spirosol-5-en-3β-ol
- (2S,2'R,4aR,4bS,5'R,6aS,6bR,7S,9aS,10aS,10bS)-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'-piperidin]-2-ol
- (3β,22α,25R)-spirosol-5-en-3-ol
- purapuridine
- solasod-5-en-3β-ol
- spiro[8H-naphth[2',1':4,5]indeno[2,1-b]furan-8,2'-piperidine]
Cross-references
- cas:126-17-0
- foodb.compound:FDB013944
- hmdb:HMDB0035282
- kegg.compound:C10822
- knapsack:C00002264
- lincs.smallmolecule:LSM-6427
- metacyc.compound:CPD-13080
Patents and articles
Activity roles
- antimicrobial agent
CHEBI:33281 - antifungal agent
CHEBI:35718
Source concepts
| Source | Native ID | Label | Minted CURIE | Version |
|---|---|---|---|---|
| CHEBI | CHEBI:9190 |
solasodine | antibioticmech:chebi-92277b0142 |
2026-08-30 |
Curation history
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SEEDED_FROM_SOURCES
Seeded from data/raw/ inventories (CHEBI)
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RESEEDED_FROM_SOURCES
Re-seeded from updated data/raw/ inventories
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RESEEDED_FROM_SOURCES
Re-seeded from updated data/raw/ inventories
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RESEEDED_FROM_SOURCES
Re-seeded from updated data/raw/ inventories
-
RESEEDED_FROM_SOURCES
Re-seeded from updated data/raw/ inventories