sigmoidin A (CAS 87746-48-3) — formula C25H28O6, molecular weight 424.5; category organic chemicals.
| CAS Number | 87746-48-3 |
|---|---|
| Molecular Formula | C25H28O6 |
| Molecular Weight | 424.5 |
| LogP | 5.9 |
| Category | Organic Chemicals |
sigmoidin A is a carbon-based organic compound with CAS registry number 87746-48-3 and molecular formula C25H28O6 (molecular weight 424.5), belonging to the organic chemicals segment of chemical raw materials.
CAS number: 87746-48-3
Its molecular formula C25H28O6 comprises 25 C, 28 H, 6 O atoms.
Also known as: sigmoidin A · 乙状结肠素A
Category: organic chemicals
The CAS registry number of sigmoidin A is 87746-48-3.
Molecular formula C25H28O6, molecular weight 424.5.
It is also registered under: sigmoidin A, 乙状结肠素A.
Category: Organic Chemicals.
Independent reference data for sigmoidin A (CAS 87746-48-3), compiled from public chemistry databases.
| CAS 号 | 87746-48-3 |
|---|---|
| PubChem CID | 73204 |
| 分子式 | C25H28O6 |
| IUPAC 名称 | (2S)-2-[3,4-dihydroxy-2,5-bis(3-methylbut-2-enyl)phenyl]-5,7-dihydroxy-2,3-dihydrochromen-4-one |
| UNII（FDA） | SM3QN39TDC |
| Molecular Weight | 424.5 |
|---|---|
| XLogP3 | 5.9 |
| Hydrogen Bond Donor Count | 4 |
| Hydrogen Bond Acceptor Count | 6 |
| Rotatable Bond Count | 5 |
| Exact Mass | 424.18858861 |
| Monoisotopic Mass | 424.18858861 |
| Topological Polar Surface Area | 107 |
| Heavy Atom Count | 31 |
Sigmoidin A; 87746-48-3; Sigmoidin-A; (2S)-2-[3,4-dihydroxy-2,5-bis(3-methylbut-2-enyl)phenyl]-5,7-dihydroxy-2,3-dihydrochromen-4-one; CHEBI:66482; DTXSID20236607; 4H-1-Benzopyran-4-one, 2-(3,4-dihydroxy-2,5-bis(3-methyl-2-butenyl)phenyl)-2,3-dihydro-5,7-dihydroxy-, (S)-; (2S)-2-(3,4-dihydroxy-2,5-bis(3-methylbut-2-enyl)phenyl)-5,7-dihydroxy-2,3-dihydrochromen-4-one; RefChem:182814; DTXCID10159098; CHEMBL229506; (2S)-2-[3,4-dihydroxy-2,5-bis(3-methylbut-2-enyl)phenyl]-5,7-dihydroxy-chroman-4-one; (2s)-2-[3,4-dihydroxy-2,5-bis(3-methylbut-2-en-1-yl)phenyl]-5,7-dihydroxy-2,3-dihydro-4h-chromen-4-one; SM3QN39TDC; SCHEMBL31502307; BDBM50212392
乙状结肠素A · CAS 87746-48-3 · C25H28O6. UNII SM3QN39TDC.
Source: PubChem / Wikidata; the batch COA governs where values differ.
Supplier: Jinan Shenghe Chemical Co., Ltd.
中文页面: 乙状结肠素A