(16α,19E,17'S,19'E)-1'-Acetyl-19,19',20,20'-tetradehydro-17,17'-oxy-12'-hydroxy-1,17'-bicuran (CAS 71610-50-9) — formula C40H46N4O3, molecular weight 630.8; category organic chemicals.
| CAS Number | 71610-50-9 |
|---|---|
| Molecular Formula | C40H46N4O3 |
| Molecular Weight | 630.8 |
| LogP | 4.2 |
| Category | Organic Chemicals |
(16α,19E,17'S,19'E)-1'-Acetyl-19,19',20,20'-tetradehydro-17,17'-oxy-12'-hydroxy-1,17'-bicuran is a carbon-based organic compound with CAS registry number 71610-50-9 and molecular formula C40H46N4O3 (molecular weight 630.8), belonging to the organic chemicals segment of chemical raw materials.
CAS number: 71610-50-9
Its molecular formula C40H46N4O3 comprises 40 C, 46 H, 4 N, 3 O atoms.
Also known as: (16α,19E,17'S,19'E)-1'-Acetyl-19,19',20,20'-tetradehydro-17,17'-oxy-12'-hydroxy-1,17'-bicuran · (16α,19E,17'S,19'E)-1'-乙酰基-19,19',20,20'-四氢-17,17'-氧基-12'-羟基-1,17'-双库喃
Category: organic chemicals
The CAS registry number of (16α,19E,17'S,19'E)-1'-Acetyl-19,19',20,20'-tetradehydro-17,17'-oxy-12'-hydroxy-1,17'-bicuran is 71610-50-9.
Molecular formula C40H46N4O3, molecular weight 630.8.
It is also registered under: (16α,19E,17'S,19'E)-1'-Acetyl-19,19',20,20'-tetradehydro-17,17'-oxy-12'-hydroxy-1,17'-bicuran, (16α,19E,17'S,19'E)-1'-乙酰基-19,19',20,20'-四氢-17,17'-氧基-12'-羟基-1,17'-双库喃.
Category: Organic Chemicals.
Independent reference data for (16α,19E,17'S,19'E)-1'-Acetyl-19,19',20,20'-tetradehydro-17,17'-oxy-12'-hydroxy-1,17'-bicuran (CAS 71610-50-9), compiled from public chemistry databases.
| CAS 号 | 71610-50-9 |
|---|---|
| PubChem CID | 5477485 |
| 分子式 | C40H46N4O3 |
| IUPAC 名称 | 1-[(12Z)-12-ethylidene-10-[(14Z)-14-ethylidene-10-oxa-8,16-diazahexacyclo[11.5.2.11,8.02,7.016,19.012,21]henicosa-2,4,6-trien-9-yl]-6-hydroxy-8,14-diazapentacyclo[9.5.2.01,9.02,7.014,17]octadeca-2(7),3,5-trien-8-yl]ethanone |
| Molecular Weight | 630.8 |
|---|---|
| XLogP3 | 4.2 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 6 |
| Rotatable Bond Count | 1 |
| Exact Mass | 630.35699134 |
| Monoisotopic Mass | 630.35699134 |
| Topological Polar Surface Area | 59.5 |
| Heavy Atom Count | 47 |
ISOSTRYCHNOBILINE, 12'-HYDROXY-; 12'-Hydroxyisostrychnobiline; 71610-50-9; NSC325311; NSC-325311; 1, 1'-acetyl-19,19',20,20'-tetradehydro-17,17'-epoxy-12'-hydroxy-, (16.alpha.,19E)-(17'S,19'E)-
(16α,19E,17'S,19'E)-1'-乙酰基-19,19',20,20'-四氢-17,17'-氧基-12'-羟基-1,17'-双库喃 · CAS 71610-50-9 · C40H46N4O3.
Source: PubChem / Wikidata; the batch COA governs where values differ.
Supplier: Jinan Shenghe Chemical Co., Ltd.
中文页面: (16α,19E,17'S,19'E)-1'-乙酰基-19,19',20,20'-四氢-17,17'-氧基-12'-羟基-1,17'-双库喃