Cas no 24987-88-0 (Gambirtannine)
Gambirtannine structure
Product Name:Gambirtannine
CAS No:24987-88-0
MF:C21H18N2O2
MW:330.379825115204
CID:284669
Update Time:2024-02-29
Gambirtannine Chemical and Physical Properties
Names and Identifiers
-
- Benz[g]indolo[2,3-a]quinolizine-1-carboxylicacid, 5,7,8,13-tetrahydro-, methyl ester (9CI)
- Gambirtannin
- Gambirtannine
- Yohimban-16-carboxylicacid, 3,14,15,16,17,18,19,20-octadehydro-, methyl ester (8CI)
- C17533
- Q27155120
-
- Inchi： 1S/C21H18N2O2/c1-25-21(24)16-7-4-5-13-12-23-10-9-15-14-6-2-3-8-18(14)22-20(15)19(23)11-17(13)16/h2-8,11,22H,9-10,12H2,1H3
- InChI Key： XXMFILHAOYZMSG-UHFFFAOYSA-N
- SMILES： O(C)C(C1=CC=CC2=C1C=C1C3=C(C4C=CC=CC=4N3)CCN1C2)=O
Computed Properties
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 25
- Rotatable Bond Count: 2
- Complexity: 574
- Topological Polar Surface Area: 45.3
Gambirtannine Related Literature
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Ivor Lon?ari? Phys. Chem. Chem. Phys., 2015,17, 9436-9445
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Bin Han,Yasuo Shimizu,Gabriele Seguini,Celia Castro,Gérard Ben Assayag,Koji Inoue,Yasuyoshi Nagai,Sylvie Schamm-Chardon,Michele Perego RSC Adv., 2016,6, 3617-3622
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Amandine Altmayer-Henzien,Valérie Declerck,David J. Aitken,Ewen Lescop,Denis Merlet,Jonathan Farjon Org. Biomol. Chem., 2013,11, 7611-7615
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Hongxia Li,Aikifa Raza,Qiaoyu Ge,Jin-You Lu,TieJun Zhang Soft Matter, 2020,16, 6841-6849
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Eléonore Resongles,Corinne Casiot,Fran?oise Elbaz-Poulichet,Rémi Freydier,Odile Bruneel,Christine Piot,Sophie Delpoux,Aurélie Volant,Angélique Desoeuvre Environ. Sci.: Processes Impacts, 2013,15, 1536-1544
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