(5aS,13aβ)-11aα-(1,1-Dimethyl-2-propenyl)-6aα-hydroxy-2,3,6,6a,11,11a-hexahydro-1H-pyrrolo[1'',2'':4',5']pyrazino[1',2':1,5]pyrrolo[2,3-b]indole-5,13(5aH,13aH)-dione (CAS 23454-27-5) — formula C21H25N3O3, molecular weight 367.4; category organic chemicals.
| CAS Number | 23454-27-5 |
|---|---|
| Molecular Formula | C21H25N3O3 |
| Molecular Weight | 367.4 |
| LogP | 2.1 |
| Category | Organic Chemicals |
(5aS,13aβ)-11aα-(1,1-Dimethyl-2-propenyl)-6aα-hydroxy-2,3,6,6a,11,11a-hexahydro-1H-pyrrolo[1'',2'':4',5']pyrazino[1',2':1,5]pyrrolo[2,3-b]indole-5,13(5aH,13aH)-dione is a carbon-based organic compound with CAS registry number 23454-27-5 and molecular formula C21H25N3O3 (molecular weight 367.4), belonging to the organic chemicals segment of chemical raw materials.
CAS number: 23454-27-5
Its molecular formula C21H25N3O3 comprises 21 C, 25 H, 3 N, 3 O atoms.
Also known as: (5aS,13aβ)-11aα-(1,1-Dimethyl-2-propenyl)-6aα-hydroxy-2,3,6,6a,11,11a-hexahydro-1H-pyrrolo[1'',2'':4',5']pyrazino[1',2':1,5]pyrrolo[2,3-b]indole-5,13(5aH,13aH)-dione · (5aS,13aβ)-11aα-(1,1-二甲基-2-丙烯基)-6aα-羟基-2,3,6,6a,11,11a-六氢-1H -吡咯并[1'',2'':4',5']吡嗪基[1',2':1,5]吡咯并[2,3-b]吲哚-5,13(5aH,13aH)-二酮
Category: organic chemicals
The CAS registry number of (5aS,13aβ)-11aα-(1,1-Dimethyl-2-propenyl)-6aα-hydroxy-2,3,6,6a,11,11a-hexahydro-1H-pyrrolo[1'',2'':4',5']pyrazino[1',2':1,5]pyrrolo[2,3-b]indole-5,13(5aH,13aH)-dione is 23454-27-5.
Molecular formula C21H25N3O3, molecular weight 367.4.
It is also registered under: (5aS,13aβ)-11aα-(1,1-Dimethyl-2-propenyl)-6aα-hydroxy-2,3,6,6a,11,11a-hexahydro-1H-pyrrolo[1'',2'':4',5']pyrazino[1',2':1,5]pyrrolo[2,3-b]indole-5,13(5aH,13aH)-dione, (5aS,13aβ)-11aα-(1,1-二甲基-2-丙烯基)-6aα-羟基-2,3,6,6a,11,11a-六氢-1H -吡咯并[1'',2'':4',5']吡嗪基[1',2':1,5]吡咯并[2,3-b]吲哚-5,13(5aH,13aH)-二酮.
Category: Organic Chemicals.
Independent reference data for (5aS,13aβ)-11aα-(1,1-Dimethyl-2-propenyl)-6aα-hydroxy-2,3,6,6a,11,11a-hexahydro-1H-pyrrolo[1'',2'':4',5']pyrazino[1',2':1,5]pyrrolo[2,3-b]indole-5,13(5aH,13aH)-dione (CAS 23454-27-5), compiled from public chemistry databases.
| CAS 号 | 23454-27-5 |
|---|---|
| PubChem CID | 185537 |
| 分子式 | C21H25N3O3 |
| IUPAC 名称 | (1S,4S,10S,12R)-12-hydroxy-1-(2-methylbut-3-en-2-yl)-2,8,19-triazapentacyclo[10.7.0.02,10.04,8.013,18]nonadeca-13,15,17-triene-3,9-dione |
| UNII（FDA） | CKM5RSM01T |
| Molecular Weight | 367.4 |
|---|---|
| XLogP3 | 2.1 |
| Hydrogen Bond Donor Count | 2 |
| Hydrogen Bond Acceptor Count | 4 |
| Rotatable Bond Count | 2 |
| Exact Mass | 367.18959167 |
| Monoisotopic Mass | 367.18959167 |
| Topological Polar Surface Area | 72.9 |
| Heavy Atom Count | 27 |
Brevianamide E; 23454-27-5; CKM5RSM01T; RefChem:121342; UNII-CKM5RSM01T; DTXSID60946112; CHEBI:219639
(5aS,13aβ)-11aα-(1,1-二甲基-2-丙烯基)-6aα-羟基-2,3,6,6a,11,11a-六氢-1H -吡咯并[1'',2'':4',5']吡嗪基[1',2':1,5]吡咯并[2,3-b]吲哚-5,13(5aH,13aH)-二酮 · CAS 23454-27-5 · C21H25N3O3. UNII CKM5RSM01T.
Source: PubChem / Wikidata; the batch COA governs where values differ.
Supplier: Jinan Shenghe Chemical Co., Ltd.