Cas no 51529-12-5 ((22E)-stigmasterone)
(22E)-stigmasterone structure
Product Name:(22E)-stigmasterone
CAS No:51529-12-5
MF:C29H46O
MW:410.674949169159
CID:2065084
Update Time:2025-03-26
(22E)-stigmasterone Chemical and Physical Properties
Names and Identifiers
-
- (22E)-stigmasterone
- stigmasterone
- (22E,24S)-Stigmast-4,22-dien-3-one
- Stigmasta-5,22-dien-3-one, (22E)-
-
- Inchi： 1S/C29H46O/c1-7-21(19(2)3)9-8-20(4)25-12-13-26-24-11-10-22-18-23(30)14-16-28(22,5)27(24)15-17-29(25,26)6/h8-10,19-21,24-27H,7,11-18H2,1-6H3
- InChI Key： XWDAKKDQJHVMKG-UHFFFAOYSA-N
- SMILES： CCC(C(C)C)C=CC(C1C2(C(C3C(CC2)C2(C(CC(CC2)=O)=CC3)C)CC1)C)C
Computed Properties
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 1
- Heavy Atom Count: 30
- XLogP3: 10.851
Experimental Properties
- Density: 0.98±0.1 g/cm3(Predicted)
- Melting Point: 84-90 °C
- Boiling Point: 497.9±14.0 °C(Predicted)
(22E)-stigmasterone Related Literature
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Christopher B. Rodell,Christopher B. Highley,Minna H. Chen,Neville N. Dusaj,Chao Wang,Lin Han,Jason A. Burdick Soft Matter, 2016,12, 7839-7847
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David White,Sean R. Stowell Biomater. Sci., 2017,5, 463-474
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Ana G. Neo,Ana Bornadiego,Jesús Díaz,Stefano Marcaccini,Carlos F. Marcos Org. Biomol. Chem., 2013,11, 6546-6555
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Ziyang Deng,Changwei Chen,Sunliang Cui RSC Adv., 2016,6, 93753-93755
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