HERNANDEZINE (CAS 6681-13-6) — formula C39H44N2O7, molecular weight 652.8; category organic chemicals.
| CAS Number | 6681-13-6 |
|---|---|
| Molecular Formula | C39H44N2O7 |
| Molecular Weight | 652.8 |
| LogP | 6.4 |
| Category | Organic Chemicals |
HERNANDEZINE is a carbon-based organic compound with CAS registry number 6681-13-6 and molecular formula C39H44N2O7 (molecular weight 652.8), belonging to the organic chemicals segment of chemical raw materials.
CAS number: 6681-13-6
Its molecular formula C39H44N2O7 comprises 39 C, 44 H, 2 N, 7 O atoms.
Also known as: HERNANDEZINE · 鹤氏唐松草碱
Category: organic chemicals
The CAS registry number of HERNANDEZINE is 6681-13-6.
Molecular formula C39H44N2O7, molecular weight 652.8.
It is also registered under: HERNANDEZINE, 鹤氏唐松草碱.
Category: Organic Chemicals.
Independent reference data for HERNANDEZINE (CAS 6681-13-6), compiled from public chemistry databases.
| CAS 号 | 6681-13-6 |
|---|---|
| PubChem CID | 72343 |
| 分子式 | C39H44N2O7 |
| IUPAC 名称 | (1S,14S)-9,19,20,21,25-pentamethoxy-15,30-dimethyl-7,23-dioxa-15,30-diazaheptacyclo[22.6.2.23,6.18,12.114,18.027,31.022,33]hexatriaconta-3(36),4,6(35),8,10,12(34),18(33),19,21,24,26,31-dodecaene |
| UNII（FDA） | HPH24MXX7G |
| Molecular Weight | 652.8 |
|---|---|
| XLogP3 | 6.4 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 9 |
| Rotatable Bond Count | 5 |
| Exact Mass | 652.31485175 |
| Monoisotopic Mass | 652.31485175 |
| Topological Polar Surface Area | 71.1 |
| Heavy Atom Count | 48 |
Hernandezine; 6681-13-6; HPH24MXX7G; DTXSID40216926; Berbaman, 5,6,6',7,12-pentamethoxy-2,2'-dimethyl-, (1beta)-; RefChem:922870; DTXCID70139417; (+)-Hernandezine; CHEBI:5677; pentamethoxy(dimethyl)[?]; dodecaene; NSC626650; UNII-HPH24MXX7G; CHEMBL504936; orb1297342; SCHEMBL16254179
鹤氏唐松草碱 · CAS 6681-13-6 · C39H44N2O7. UNII HPH24MXX7G.
Source: PubChem / Wikidata; the batch COA governs where values differ.
Supplier: Jinan Shenghe Chemical Co., Ltd.
中文页面: 鹤氏唐松草碱