Cas no 949087-26-7 (3,20-Diaminopregn-5-en-18-ol; (3β,20S)-form, N20-Hydroxy, N20-Ac)
949087-26-7 structure
Product Name:3,20-Diaminopregn-5-en-18-ol; (3β,20S)-form, N20-Hydroxy, N20-Ac
CAS No:949087-26-7
MF:C23H38N2O3
MW:390.559426784515
CID:6674435
Update Time:2024-03-02
3,20-Diaminopregn-5-en-18-ol; (3β,20S)-form, N20-Hydroxy, N20-Ac Chemical and Physical Properties
Names and Identifiers
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- Holadysenterine
- 3,20-Diaminopregn-5-en-18-ol; (3β,20S)-form, N20-Hydroxy, N20-Ac
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- Inchi: 1S/C23H38N2O3/c1-14(25(28)15(2)27)19-6-7-21-18-5-4-16-12-17(24)8-10-22(16,3)20(18)9-11-23(19,21)13-26/h4,14,17-21,26,28H,5-13,24H2,1-3H3
- InChI Key: GPRPCDRSJAFGHU-UHFFFAOYSA-N
- SMILES: CC(N(C(=O)C)O)C1C2(C(C3C(CC2)C2(C(CC(CC2)N)=CC3)C)CC1)CO
Computed Properties
- Hydrogen Bond Donor Count: 3
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 28
- XLogP3: 2.974
3,20-Diaminopregn-5-en-18-ol; (3β,20S)-form, N20-Hydroxy, N20-Ac Related Literature
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Alexandre Vimont,Arnaud Travert,Philippe Bazin,Jean-Claude Lavalley,Marco Daturi,Christian Serre,Gérard Férey,Sandrine Bourrelly,Philip L. Llewellyn Chem. Commun., 2007, 3291-3293
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Hanie Hashtroudi,Ian D. R. Mackinnon J. Mater. Chem. C, 2020,8, 13108-13126
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Xing Zhao,Lu Bai,Rui-Ying Bao,Zheng-Ying Liu,Ming-Bo Yang,Wei Yang RSC Adv., 2017,7, 46297-46305
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Ross Harder,David C. Dunand,Ian McNulty Nanoscale, 2017,9, 5686-5693
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Vishwesh Venkatraman,Marco Foscato,Vidar R. Jensen,Bj?rn K?re Alsberg J. Mater. Chem. A, 2015,3, 9851-9860
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