Cas no 53683-72-0 (Picrasa-3,13(21)-diene-2,16-dione,11,20-epoxy-1,11,12,15-tetrahydroxy-, (1b,11b,12a,15b)- (9CI))
53683-72-0 structure
Product Name:Picrasa-3,13(21)-diene-2,16-dione,11,20-epoxy-1,11,12,15-tetrahydroxy-, (1b,11b,12a,15b)- (9CI)
CAS No:53683-72-0
MF:C20H24O8
MW:392.399766921997
CID:381721
PubChem ID:315130
Update Time:2025-04-19
Picrasa-3,13(21)-diene-2,16-dione,11,20-epoxy-1,11,12,15-tetrahydroxy-, (1b,11b,12a,15b)- (9CI) Chemical and Physical Properties
Names and Identifiers
-
- Picrasa-3,13(21)-diene-2,16-dione,11,20-epoxy-1,11,12,15-tetrahydroxy-, (1b,11b,12a,15b)- (9CI)
- Δ13,18-Glaucarubolon
- .DELTA.13-Dehydroglaucarubolone
- NSC238189
- NSC-238189
- 53683-72-0
- DTXSID20311125
- GLAUCARUBOLINE,13-DEHYDRO-
-
- Inchi： 1S/C20H24O8/c1-7-4-10(21)15(24)18(3)9(7)5-11-19-6-27-20(26,17(18)19)14(23)8(2)12(19)13(22)16(25)28-11/h4,9,11-15,17,22-24,26H,2,5-6H2,1,3H3
- InChI Key： KLIWNUFFQIBFNA-UHFFFAOYSA-N
- SMILES： O1CC23C4C(C(=O)OC2CC2C(C)=CC(C(C2(C)C3C1(C(C4=C)O)O)O)=O)O
Computed Properties
- Exact Mass: 392.14711772g/mol
- Monoisotopic Mass: 392.14711772g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 4
- Hydrogen Bond Acceptor Count: 8
- Heavy Atom Count: 28
- Rotatable Bond Count: 0
- Complexity: 849
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 10
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- XLogP3: -1.7
- Topological Polar Surface Area: 134?2
Picrasa-3,13(21)-diene-2,16-dione,11,20-epoxy-1,11,12,15-tetrahydroxy-, (1b,11b,12a,15b)- (9CI) Related Literature
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1. Fatty acid eutectic mixtures and derivatives from non-edible animal fat as phase change materials?Pau Gallart-Sirvent,Marc Martín,Gemma Villorbina,Mercè Balcells,Aran Solé,Luisa F. Cabeza,Ramon Canela-Garayoa RSC Adv., 2017,7, 24133-24139
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Eléonore Resongles,Corinne Casiot,Fran?oise Elbaz-Poulichet,Rémi Freydier,Odile Bruneel,Christine Piot,Sophie Delpoux,Aurélie Volant,Angélique Desoeuvre Environ. Sci.: Processes Impacts, 2013,15, 1536-1544
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Long Deng,Qian Zou,Biao Liu,Wenhui Ye,Chengfei Zhuo,Li Chen,Ze-Yuan Deng,Ya-Wei Fan,Jing Li Food Funct., 2018,9, 4234-4245
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Shun-Ze Zhan,Mian Li,Xiao-Ping Zhou,Dan Li,Seik Weng Ng RSC Adv., 2011,1, 1457-1459
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Sowmyalakshmi Venkataraman RSC Adv., 2015,5, 73807-73813
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