Cas no 29430-26-0 (Androst-4-en-3-one,17-[(1-oxo-10-undecenyl)oxy]-, (17b)- (9CI))
29430-26-0 structure
Product Name:Androst-4-en-3-one,17-[(1-oxo-10-undecenyl)oxy]-, (17b)- (9CI)
CAS No:29430-26-0
MF:C30H46O3
MW:454.684449672699
CID:258957
PubChem ID:9846790
Update Time:2025-04-19
Androst-4-en-3-one,17-[(1-oxo-10-undecenyl)oxy]-, (17b)- (9CI) Chemical and Physical Properties
Names and Identifiers
-
- Androst-4-en-3-one,17-[(1-oxo-10-undecenyl)oxy]-, (17b)- (9CI)
- 17beta-Hydroxyandrost-4-en-3-one undecenoate
- 3-oxoandrost-4-en-17-yl undec-10-enoate
- ANDROST-4-EN-3-ONE, 17-((1-OXO-10-UNDECEN-1-YL)OXY)-, (17.BETA.)-
- KU65V22IOU
- EINECS 249-624-7
- SCHEMBL23924151
- TESTOSTERONE UNDECYLENATE [WHO-DD]
- DTXSID10951953
- Testosterone undecylenate
- 29430-26-0
- UNII-KU65V22IOU
-
- Inchi: 1S/C30H46O3/c1-4-5-6-7-8-9-10-11-12-28(32)33-27-16-15-25-24-14-13-22-21-23(31)17-19-29(22,2)26(24)18-20-30(25,27)3/h4,21,24-27H,1,5-20H2,2-3H3/t24-,25-,26-,27-,29-,30-/m0/s1
- InChI Key: PBFYIQCFOZXSKC-CNQKSJKFSA-N
- SMILES: O(C(CCCCCCCCC=C)=O)[C@H]1CC[C@H]2[C@@H]3CCC4=CC(CC[C@]4(C)[C@H]3CC[C@@]21C)=O
Computed Properties
- Exact Mass: 454.34469533g/mol
- Monoisotopic Mass: 454.34469533g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 33
- Rotatable Bond Count: 11
- Complexity: 767
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 6
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- XLogP3: 8
- Topological Polar Surface Area: 43.4?2
Androst-4-en-3-one,17-[(1-oxo-10-undecenyl)oxy]-, (17b)- (9CI) Related Literature
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Guiying Zhang,Maosheng Cheng,Yanni Li,Keliang Liu,Lifeng Cai Chem. Commun., 2013,49, 11086-11088
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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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Bo Wei,Zhenyu Liu,Chen Xie,Shu Yang,Wentao Tang,Aiwei Gu,Wing-Tak Wong,Ka-Leung Wong J. Mater. Chem. C, 2015,3, 12322-12327
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Xiaoming Liu,Zachary D. Hood,Wangda Li,Donovan N. Leonard,Arumugam Manthiram,Miaofang Chi J. Mater. Chem. A, 2021,9, 2111-2119
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