Account methyl (Z)-4-ethylidene-1-hydroxy-14-(hydroxymethyl)-2,3,4,5,7,8-hexahydro-1H,13H-3,8a-methanoazepino[1',2':1,2]pyrrolo[2,3-b]indole-14-carboxylate
- Catalog No. :
- ACBWEE954
- CAS No. :
- 60048-88-6
- Molecular Formula :
- C21H26N2O4
- Molecular Weight :
- 370.45
IUPAC Name:methyl (Z)-4-ethylidene-1-hydroxy-14-(hydroxymethyl)-2,3,4,5,7,8-hexahydro-1H,13H-3,8a-methanoazepino[1',2':1,2]pyrrolo[2,3-b]indole-14-carboxylate
![methyl (Z)-4-ethylidene-1-hydroxy-14-(hydroxymethyl)-2,3,4,5,7,8-hexahydro-1H,13H-3,8a-methanoazepino[1',2':1,2]pyrrolo[2,3-b]indole-14-carboxylate structure diagram](/images/productimg/no-pic.svg)
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Product Information
| Product Name | methyl (Z)-4-ethylidene-1-hydroxy-14-(hydroxymethyl)-2,3,4,5,7,8-hexahydro-1H,13H-3,8a-methanoazepino[1',2':1,2]pyrrolo[2,3-b]indole-14-carboxylate |
|---|---|
| IUPAC Name | methyl (Z)-4-ethylidene-1-hydroxy-14-(hydroxymethyl)-2,3,4,5,7,8-hexahydro-1H,13H-3,8a-methanoazepino[1',2':1,2]pyrrolo[2,3-b]indole-14-carboxylate |
| Molecular Formula | C21H26N2O4 |
| Molecular Weight | 370.45 |
| SMILES | C/C=C1\CN2CCC34C5=CC=CC=C5NC23C(O)CC1C4(CO)C(=O)OC |
| InChI Key | VZZBVNLFHYEUHM-QLKAYGNNSA-N |
| Synonym | N-Demethylechitamine;13H-3,8a-Methano-1H-azepino[1',2':1,2]pyrrolo[2,3-b]indole-14-carboxylic acid, 4-ethylidene-2,3,4,5,7,8-hexahydro-1-hydroxy-14-(hydroxymethyl)-, methyl ester, (1S,3S,4E,6S,8aS,13aR,14R)-;Nb-demethylechitamine |
| CAS No. | 60048-88-6 |
Synthetic Route by SureRoute
2. ACBWEE954 Molecular Building Block Synthetic Route
(1S,3S,6S,8aS,13aR,14R,E)-4-ethylidene-1-hydroxy-14-(hydroxymethyl)-14-(methoxycarbonyl)-6-methyl-1,2,3,4,5,6,7,8-octahydro-13H-3,8a-methanoazepino[1',2':1,2]pyrrolo[2,3-b]indol-6-ium chloride
4-ethylidene-1-hydroxy-14-(hydroxymethyl)-14-(methoxycarbonyl)-6-methyl-1,2,3,4,5,6,7,8-octahydro-13H-3,8a-methanoazepino[1',2':1,2]pyrrolo[2,3-b]indol-6-ium
(1S,3R,6S,8aS,13aR,14R,E)-4-ethylidene-1-hydroxy-14-(hydroxymethyl)-6-methyl-1,2,3,4,5,6,7,8-octahydro-13H-3,8a-methanoazepino[1',2':1,2]pyrrolo[2,3-b]indol-6-ium-14-carboxylate