[(1aS)-1a,1bα,2,5aα,6,6aβ-Hexahydro-6α-hydroxy-1a-[(cinnamoyloxy)methyl]oxireno[4,5]cyclopenta[1,2-c]pyran-2α-yl]β-D-glucopyranoside (CAS 1399-49-1) — formula C24H28O11, molecular weight 492.5; category organic chemicals.
| CAS Number | 1399-49-1 |
|---|---|
| Molecular Formula | C24H28O11 |
| Molecular Weight | 492.5 |
| LogP | -0.6 |
| Category | Organic Chemicals |
[(1aS)-1a,1bα,2,5aα,6,6aβ-Hexahydro-6α-hydroxy-1a-[(cinnamoyloxy)methyl]oxireno[4,5]cyclopenta[1,2-c]pyran-2α-yl]β-D-glucopyranoside is a carbon-based organic compound with CAS registry number 1399-49-1 and molecular formula C24H28O11 (molecular weight 492.5), belonging to the organic chemicals segment of chemical raw materials.
CAS number: 1399-49-1
Its molecular formula C24H28O11 comprises 24 C, 28 H, 11 O atoms.
Also known as: [(1aS)-1a,1bα,2,5aα,6,6aβ-Hexahydro-6α-hydroxy-1a-[(cinnamoyloxy)methyl]oxireno[4,5]cyclopenta[1,2-c]pyran-2α-yl]β-D-glucopyranoside · 球花苦苷
Category: organic chemicals
The CAS registry number of [(1aS)-1a,1bα,2,5aα,6,6aβ-Hexahydro-6α-hydroxy-1a-[(cinnamoyloxy)methyl]oxireno[4,5]cyclopenta[1,2-c]pyran-2α-yl]β-D-glucopyranoside is 1399-49-1.
Molecular formula C24H28O11, molecular weight 492.5.
It is also registered under: [(1aS)-1a,1bα,2,5aα,6,6aβ-Hexahydro-6α-hydroxy-1a-[(cinnamoyloxy)methyl]oxireno[4,5]cyclopenta[1,2-c]pyran-2α-yl]β-D-glucopyranoside, 球花苦苷.
Category: Organic Chemicals.
Independent reference data for [(1aS)-1a,1bα,2,5aα,6,6aβ-Hexahydro-6α-hydroxy-1a-[(cinnamoyloxy)methyl]oxireno[4,5]cyclopenta[1,2-c]pyran-2α-yl]β-D-glucopyranoside (CAS 1399-49-1), compiled from public chemistry databases.
| CAS 号 | 1399-49-1 |
|---|---|
| PubChem CID | 21603201 |
| 分子式 | C24H28O11 |
| IUPAC 名称 | [(1S,2S,4S,5S,6R,10S)-5-hydroxy-10-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-3,9-dioxatricyclo[4.4.0.02,4]dec-7-en-2-yl]methyl (E)-3-phenylprop-2-enoate |
| UNII（FDA） | NS00093932 |
| Molecular Weight | 492.5 |
|---|---|
| XLogP3 | -0.6 |
| Hydrogen Bond Donor Count | 5 |
| Hydrogen Bond Acceptor Count | 11 |
| Rotatable Bond Count | 8 |
| Exact Mass | 492.16316171 |
| Monoisotopic Mass | 492.16316171 |
| Topological Polar Surface Area | 168 |
| Heavy Atom Count | 35 |
Globularin; 1399-49-1; DTXSID301347703; RefChem:1085815; DTXCID301776435; MEGxp0_000535; orb1682494; SCHEMBL9057920; ACon1_000554; TN4138; AKOS040761785; MG45064; NCGC00168968-01; NCGC00168968-03; FS-10335; CS-0024501
球花苦苷 · CAS 1399-49-1 · C24H28O11. UNII NS00093932.
Source: PubChem / Wikidata; the batch COA governs where values differ.
Supplier: Jinan Shenghe Chemical Co., Ltd.
中文页面: 球花苦苷