Cas no 79082-34-1 ((Z)-6alpha-acetoxylabda-8(17),12,14-trien-19-oic acid)
79082-34-1 structure
Product Name:(Z)-6alpha-acetoxylabda-8(17),12,14-trien-19-oic acid
CAS No:79082-34-1
MF:C22H32O4
MW:360.487087249756
CID:2035042
Update Time:2025-04-21
(Z)-6alpha-acetoxylabda-8(17),12,14-trien-19-oic acid Chemical and Physical Properties
Names and Identifiers
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- (Z)-6alpha-acetoxylabda-8(17),12,14-trien-19-oic acid
- 6-Acetoxy-8(17),12,14-labdatrien-19-oic acid
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- Inchi： 1S/C22H32O4/c1-7-14(2)9-10-17-15(3)13-18(26-16(4)23)19-21(17,5)11-8-12-22(19,6)20(24)25/h7,9,17-19H,1,3,8,10-13H2,2,4-6H3,(H,24,25)/b14-9-
- InChI Key： QEGKOTVMJLTBMK-ZROIWOOFSA-N
- SMILES： CC(OC1C2C(CCCC2(C(=O)O)C)(C)C(C/C=C(\C=C)/C)C(=C)C1)=O
Computed Properties
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 4
- Heavy Atom Count: 26
- XLogP3: 5.273
(Z)-6alpha-acetoxylabda-8(17),12,14-trien-19-oic acid Related Literature
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Chung-Sung Yang,Mong-Shian Shih,Fang-Yi Chang New J. Chem., 2006,30, 729-735
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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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Guiying Zhang,Maosheng Cheng,Yanni Li,Keliang Liu,Lifeng Cai Chem. Commun., 2013,49, 11086-11088
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Qiao Song,Angela Bamesberger,Lingyun Yang,Haley Houtwed,Haishi Cao Analyst, 2014,139, 3588-3592
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