12'-Hydroxy-2'-methyl-5'α-[(S)-1-methylpropyl]ergotaman-3',6',18-trione (CAS 60192-59-8) — formula C30H37N5O5, molecular weight 547.6; category organic chemicals.
| CAS Number | 60192-59-8 |
|---|---|
| Molecular Formula | C30H37N5O5 |
| Molecular Weight | 547.6 |
| LogP | 1.8 |
| Category | Organic Chemicals |
12'-Hydroxy-2'-methyl-5'α-[(S)-1-methylpropyl]ergotaman-3',6',18-trione is a carbon-based organic compound with CAS registry number 60192-59-8 and molecular formula C30H37N5O5 (molecular weight 547.6), belonging to the organic chemicals segment of chemical raw materials.
CAS number: 60192-59-8
Its molecular formula C30H37N5O5 comprises 30 C, 37 H, 5 N, 5 O atoms.
Also known as: 12'-Hydroxy-2'-methyl-5'α-[(S)-1-methylpropyl]ergotaman-3',6',18-trione · 12'-羟基-2'-甲基-5'α-[(S)-1-甲基丙基]麦角麦角-3',6',18-三酮
Category: organic chemicals
The CAS registry number of 12'-Hydroxy-2'-methyl-5'α-[(S)-1-methylpropyl]ergotaman-3',6',18-trione is 60192-59-8.
Molecular formula C30H37N5O5, molecular weight 547.6.
It is also registered under: 12'-Hydroxy-2'-methyl-5'α-[(S)-1-methylpropyl]ergotaman-3',6',18-trione, 12'-羟基-2'-甲基-5'α-[(S)-1-甲基丙基]麦角麦角-3',6',18-三酮.
Category: Organic Chemicals.
Independent reference data for 12'-Hydroxy-2'-methyl-5'α-[(S)-1-methylpropyl]ergotaman-3',6',18-trione (CAS 60192-59-8), compiled from public chemistry databases.
| CAS 号 | 60192-59-8 |
|---|---|
| PubChem CID | 173722 |
| 分子式 | C30H37N5O5 |
| IUPAC 名称 | (6aR,9R)-N-[(1S,2S,4R,7R)-7-[(2S)-butan-2-yl]-2-hydroxy-4-methyl-5,8-dioxo-3-oxa-6,9-diazatricyclo[7.3.0.02,6]dodecan-4-yl]-7-methyl-6,6a,8,9-tetrahydro-4H-indolo[4,3-fg]quinoline-9-carboxamide |
| Molecular Weight | 547.6 |
|---|---|
| XLogP3 | 1.8 |
| Hydrogen Bond Donor Count | 3 |
| Hydrogen Bond Acceptor Count | 6 |
| Rotatable Bond Count | 4 |
| Exact Mass | 547.27946930 |
| Monoisotopic Mass | 547.27946930 |
| Topological Polar Surface Area | 118 |
| Heavy Atom Count | 40 |
12'-羟基-2'-甲基-5'α-[(S)-1-甲基丙基]麦角麦角-3',6',18-三酮 · CAS 60192-59-8 · C30H37N5O5.
Source: PubChem / Wikidata; the batch COA governs where values differ.
Supplier: Jinan Shenghe Chemical Co., Ltd.