Cas no 237432-16-5 (5,6,11-Trideoxytetrodotoxin; 6,11-Dihydroxy)
237432-16-5 structure
Product Name:5,6,11-Trideoxytetrodotoxin; 6,11-Dihydroxy
CAS No:237432-16-5
MF:C11H17N3O7
MW:303.268583059311
CID:6776469
Update Time:2024-03-06
5,6,11-Trideoxytetrodotoxin; 6,11-Dihydroxy Chemical and Physical Properties
Names and Identifiers
-
- 3H-7,8a-(Epoxyethano)quinazolin-10-one, 2-amino-4,4a,5,6,7,8-hexahydro-4,6,8,9-tetrahydroxy-6-(hydroxymethyl)-, (4R,4aS,6R,7S,8S,8aR,9S)-
- 5,6,11-Trideoxytetrodotoxin; 6,11-Dihydroxy
-
- Inchi： 1S/C11H17N3O7/c12-9-13-7(18)3-1-10(20,2-15)6-4(16)11(3,14-9)5(17)8(19)21-6/h3-7,15-18,20H,1-2H2,(H3,12,13,14)
- InChI Key： MUWJNPOMZLQMND-UHFFFAOYSA-N
- SMILES： OCC1(C2OC(C(C3(C(C(NC(N3)=N)O)C1)C2O)O)=O)O
Experimental Properties
- Density: 2.30±0.1 g/cm3(Predicted)
- Boiling Point: 733.3±70.0 °C(Predicted)
- pka: 12.34±0.70(Predicted)
5,6,11-Trideoxytetrodotoxin; 6,11-Dihydroxy Related Literature
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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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Jonas Kind,Lukas Kaltschnee,Martin Leyendecker,Christina M. Thiele Chem. Commun., 2016,52, 12506-12509
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Peiyuan Zeng,Xiaoxiao Wang,Ming Ye,Qiuyang Ma,Jianwen Li,Wanwan Wang,Baoyou Geng,Zhen Fang RSC Adv., 2016,6, 23074-23084
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Denis V. Korchagin,Elena A. Yureva,Alexander V. Akimov,Eugenii Ya. Misochko,Gennady V. Shilov,Artem D. Talantsev,Roman B. Morgunov,Alexander A. Shakin,Sergey M. Aldoshin,Boris S. Tsukerblat Dalton Trans., 2017,46, 7540-7548
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