Sigmoidin D
(2S)-2-[(3S)-3,8-dihydroxy-2,2-dimethyl-3,4-dihydrochromen-6-yl]-5,7-dihydroxy-2,3-dihydrochromen-4-one
Also Known As: Sigmoidin D|Sigmoidin-D|(2S)-2-[(3S)-3,8-dihydroxy-2,2-dimethyl-3,4-dihydrochromen-6-yl]-5,7-dihydroxy-2,3-dihydrochromen-4-one|(2,6'-Bi-4H-1-Benzopyran)-4-one, 2,2',3,3'-tetrahydro-3',5,7,8'-tetrahydroxy-2',2'-dimethyl-, (S-(R*,R*))-|(2S)-2-((3S)-3,8-dihydroxy-2,2-dimethyl-3,4-dihydrochromen-6-yl)-5,7-dihydroxy-2,3-dihydrochromen-4-one|(2S,3'S)-3',5,7,8'-Tetrahydroxy-2',2'-dimethyl-2,3,3',4'-tetrahydro-2'H,4H-[2,6'-bi-1-benzopyran]-4-one
| Molecular Formula | C20H20O7 |
|---|---|
| Molecular Weight | 372.1209 g/mol |
| LogP | 2.4 |
| Topological Polar Surface Area | 116.0 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 1 |
| Exact Mass | 372.1209 |
| Monoisotopic Mass | 372.1209 |
| Heavy Atoms | 27 |
| Complexity | 579.0 |
Chemical Identifiers
| CAS Number | 106533-44-2 |
|---|---|
| SMILES | CC1([C@H](CC2=C(O1)C(=CC(=C2)[C@@H]3CC(=O)C4=C(C=C(C=C4O3)O)O)O)O)C |
| InChIKey | ASQDBJSRWIDYKK-RDJZCZTQSA-N |
Product Overview
Sigmoidin D (CAS 106533-44-2), with molecular formula C20H20O7 and molecular weight 372.1209 g/mol. IUPAC: (2S)-2-[(3S)-3,8-dihydroxy-2,2-dimethyl-3,4-dihydrochromen-6-yl]-5,7-dihydroxy-2,3-dihydrochromen-4-one.
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