Batrachotoxinin A 20-(4,5-dimethyl-1H-pyrrole-3-carboxylate) (CAS 32476-55-4) — formula C31H42N2O6, molecular weight 538.7; category organic chemicals.
| CAS Number | 32476-55-4 |
|---|---|
| Molecular Formula | C31H42N2O6 |
| Molecular Weight | 538.7 |
| LogP | 1.6 |
| Category | Organic Chemicals |
Batrachotoxinin A 20-(4,5-dimethyl-1H-pyrrole-3-carboxylate) is a carbon-based organic compound with CAS registry number 32476-55-4 and molecular formula C31H42N2O6 (molecular weight 538.7), belonging to the organic chemicals segment of chemical raw materials.
CAS number: 32476-55-4
Its molecular formula C31H42N2O6 comprises 31 C, 42 H, 2 N, 6 O atoms.
Also known as: Batrachotoxinin A 20-(4,5-dimethyl-1H-pyrrole-3-carboxylate) · 蝙蝠毒素 A 20-(4,5-二甲基-1H-吡咯-3-羧酸酯)
Category: organic chemicals
The CAS registry number of Batrachotoxinin A 20-(4,5-dimethyl-1H-pyrrole-3-carboxylate) is 32476-55-4.
Molecular formula C31H42N2O6, molecular weight 538.7.
It is also registered under: Batrachotoxinin A 20-(4,5-dimethyl-1H-pyrrole-3-carboxylate), 蝙蝠毒素 A 20-(4,5-二甲基-1H-吡咯-3-羧酸酯).
Category: Organic Chemicals.
Independent reference data for Batrachotoxinin A 20-(4,5-dimethyl-1H-pyrrole-3-carboxylate) (CAS 32476-55-4), compiled from public chemistry databases.
| CAS 号 | 32476-55-4 |
|---|---|
| PubChem CID | 36144 |
| 分子式 | C31H42N2O6 |
| IUPAC 名称 | 1-[(1R,5R,6S,9S,12R)-9,12-dihydroxy-6,16-dimethyl-10,19-dioxa-16-azahexacyclo[12.5.3.15,9.01,14.02,11.06,11]tricosa-2,21-dien-22-yl]ethyl 4,5-dimethyl-1H-pyrrole-3-carboxylate |
| Molecular Weight | 538.7 |
|---|---|
| XLogP3 | 1.6 |
| Hydrogen Bond Donor Count | 3 |
| Hydrogen Bond Acceptor Count | 7 |
| Rotatable Bond Count | 4 |
| Exact Mass | 538.30428706 |
| Monoisotopic Mass | 538.30428706 |
| Topological Polar Surface Area | 104 |
| Heavy Atom Count | 39 |
4,5-Dimethylbatrachotoxin; Batrachotoxinin A, 20-(4,5-dimethylpyrrole-3-carboxylate); BATRACHOTOXININ A, 20-alpha-(4,5-DIMETHYL-1H-PYRROLE-3-CARBOXYLATE); 32476-55-4; RefChem:320982; DTXSID70954223
蝙蝠毒素 A 20-(4,5-二甲基-1H-吡咯-3-羧酸酯) · CAS 32476-55-4 · C31H42N2O6.
Source: PubChem / Wikidata; the batch COA governs where values differ.
Supplier: Jinan Shenghe Chemical Co., Ltd.