Cas no 2517-52-4 (6H,13aH-3a,5a-Ethano-1H-indolizino[8,1-cd]carbazole-5-carboxylicacid, 6-formyl-2,3,4,5,11,12-hexahydro-7-methoxy-, methyl ester,(3aR,5R,5aR,10bR,13aS)- (9CI))
![6H,13aH-3a,5a-Ethano-1H-indolizino[8,1-cd]carbazole-5-carboxylicacid, 6-formyl-2,3,4,5,11,12-hexahydro-7-methoxy-, methyl ester,(3aR,5R,5aR,10bR,13aS)- (9CI) structure](https://ossimg.kuujia.com/scimg/3000/2517-52-4x500.png)
2517-52-4 structure
Product Name:6H,13aH-3a,5a-Ethano-1H-indolizino[8,1-cd]carbazole-5-carboxylicacid, 6-formyl-2,3,4,5,11,12-hexahydro-7-methoxy-, methyl ester,(3aR,5R,5aR,10bR,13aS)- (9CI)
CAS No:2517-52-4
MF:C23H28N2O4
MW:396.479426383972
CID:263469
PubChem ID:494041
Update Time:2025-04-19
6H,13aH-3a,5a-Ethano-1H-indolizino[8,1-cd]carbazole-5-carboxylicacid, 6-formyl-2,3,4,5,11,12-hexahydro-7-methoxy-, methyl ester,(3aR,5R,5aR,10bR,13aS)- (9CI) Chemical and Physical Properties
Names and Identifiers
-
- 6H,13aH-3a,5a-Ethano-1H-indolizino[8,1-cd]carbazole-5-carboxylicacid, 6-formyl-2,3,4,5,11,12-hexahydro-7-methoxy-, methyl ester,(3aR,5R,5aR,10bR,13aS)- (9CI)
- 6H,13aH-3a,5a-Ethano-1H-indolizino[8,1-cd]carbazole-5-carboxylicacid, 6-formyl-2,3,4,5,11,12-hexahydro-7-methoxy-, methyl est
- 21-Isorefractine
- NSC 78734
- Aspidofractinine-3-carboxylic acid, 1-formyl-17-methoxy-, methyl ester, (2.alpha.,3.beta.,5.alpha.)-
- Vellosine
- Refractine
- NSC78734
- 2517-52-4
- NJLKGEGVAFDBDJ-UHFFFAOYSA-N
- Methyl 1-formyl-17-methoxyaspidofractinine-3-carboxylate
- methyl formyl(methoxy)[?]carboxylate
- Methyl 1-formyl-17-methoxyaspidofractinine-3-carboxylate #
- NCIOpen2_008824
- Refractin
-
- Inchi： 1S/C23H28N2O4/c1-28-17-6-3-5-15-18(17)25(14-26)23-9-8-21(13-16(23)19(27)29-2)7-4-11-24-12-10-22(15,23)20(21)24/h3,5-6,14,16,20H,4,7-13H2,1-2H3
- InChI Key： NJLKGEGVAFDBDJ-UHFFFAOYSA-N
- SMILES： O(C)C(C1CC23CCCN4CCC5(C6C=CC=C(C=6N(C=O)C51CC2)OC)C43)=O
Computed Properties
- Exact Mass: 396.205
- Monoisotopic Mass: 396.205
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 5
- Heavy Atom Count: 29
- Rotatable Bond Count: 3
- Complexity: 744
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 5
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- XLogP3: 2.3
- Topological Polar Surface Area: 59.1?2
Experimental Properties
- Density: 1.34
- Boiling Point: 573.4°Cat760mmHg
- Flash Point: 300.6°C
- Refractive Index: 1.646
- PSA: 59.08000
- LogP: 3.12820
6H,13aH-3a,5a-Ethano-1H-indolizino[8,1-cd]carbazole-5-carboxylicacid, 6-formyl-2,3,4,5,11,12-hexahydro-7-methoxy-, methyl ester,(3aR,5R,5aR,10bR,13aS)- (9CI) Related Literature
-
Luis Miguel Azofra,Douglas R. MacFarlane,Chenghua Sun Chem. Commun., 2016,52, 3548-3551
-
2. An all-solid-state imprinted polymer-based potentiometric sensor for determination of bisphenol S?Rongning Liang,Tanji Yin,Ruiqing Yao,Wei Qin RSC Adv., 2016,6, 73308-73312
-
Kaiyuan Huang,Wangkang Qiu,Meilian Ou,Xiaorui Liu,Zenan Liao,Sheng Chu RSC Adv., 2020,10, 18824-18829
-
Bidou Wang,Xifeng Chen Analyst, 2014,139, 5695-5699
-
Lei Yang,Yuan Zeng,Haibo Wu,Chunwu Zhou,Lei Tao J. Mater. Chem. B, 2020,8, 1383-1388
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