Cas no 84474-35-1 (Trichothec-9-ene-3,4,8,15-tetrol,12,13-epoxy-, 4,15-diacetate 8-(3-hydroxy-3-methylbutanoate), (3a,4b,8a)- (9CI))
84474-35-1 structure
Product Name:Trichothec-9-ene-3,4,8,15-tetrol,12,13-epoxy-, 4,15-diacetate 8-(3-hydroxy-3-methylbutanoate), (3a,4b,8a)- (9CI)
CAS No:84474-35-1
MF:C24H34O10
MW:482.520768642426
CID:707291
PubChem ID:121596580
Update Time:2025-04-19
Trichothec-9-ene-3,4,8,15-tetrol,12,13-epoxy-, 4,15-diacetate 8-(3-hydroxy-3-methylbutanoate), (3a,4b,8a)- (9CI) Chemical and Physical Properties
Names and Identifiers
-
- Trichothec-9-ene-3,4,8,15-tetrol,12,13-epoxy-, 4,15-diacetate 8-(3-hydroxy-3-methylbutanoate), (3a,4b,8a)- (9CI)
- 3'-hydroxy-T-2 toxin
- 3'-Hydroxy-toxin T-2
- 3'-Hydroxy-T 2
- 84474-35-1
- DTXSID901021335
- Q27896361
- TRICHOTHEC-9-ENE-3,4,8,15-TETROL, 12,13-EPOXY-, 4,15-DIACETATE 8-(3-HYDROXY-3-METHYLBUTANOATE), (3.ALPHA.,4.BETA.,8.ALPHA.)-
- QH9B9APL9T
- UNII-QH9B9APL9T
- 3'-hydroxy T-2 toxin
- 19-OH-T-2 toxin
- Trichothec-9-ene-3,4,8,15-tetrol, 12,13-epoxy-, 4,15-diacetate 8-(3-hydroxy-3-methylbutanoate), (3-alpha,4-beta,8-alpha)-
- 3'-Hydroxy T2 toxin
- DTXSID001004754
- [(2R,4S,7R,9R,10R,11S)-11-acetyloxy-2-(acetyloxymethyl)-10-hydroxy-1,5-dimethylspiro[8-oxatricyclo[7.2.1.02,7]dodec-5-ene-12,2'-oxirane]-4-yl] 3-hydroxy-3-methylbutanoate
- 4,15-Bis(acetyloxy)-3-hydroxy-12,13-epoxytrichothec-9-en-8-yl 3-hydroxy-3-methylbutanoate
-
- Inchi： 1S/C24H34O10/c1-12-7-16-23(10-30-13(2)25,8-15(12)33-17(27)9-21(4,5)29)22(6)19(32-14(3)26)18(28)20(34-16)24(22)11-31-24/h7,15-16,18-20,28-29H,8-11H2,1-6H3/t15-,16+,18+,19+,20+,22+,23+,24-/m0/s1
- InChI Key： MLDQZNYFEGLVAS-GGTUAJKXSA-N
- SMILES： O1C[C@]21[C@H]1[C@@H]([C@H]([C@]2(C)[C@@]2(COC(C)=O)C[C@@H](C(C)=C[C@H]2O1)OC(CC(C)(C)O)=O)OC(C)=O)O
Computed Properties
- Exact Mass: 482.215197
- Monoisotopic Mass: 482.215197
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 2
- Hydrogen Bond Acceptor Count: 10
- Heavy Atom Count: 34
- Rotatable Bond Count: 9
- Complexity: 927
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 6
- Undefined Atom Stereocenter Count : 2
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- Topological Polar Surface Area: 141
- XLogP3: -0.5
Trichothec-9-ene-3,4,8,15-tetrol,12,13-epoxy-, 4,15-diacetate 8-(3-hydroxy-3-methylbutanoate), (3a,4b,8a)- (9CI) Related Literature
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Yiding Jiao,Liqun Kang,Jasper Berry-Gair,Kit McColl,Jianwei Li,Haobo Dong,Hao Jiang,Ryan Wang,Furio Corà,Dan J. L. Brett,Ivan P. Parkin J. Mater. Chem. A, 2020,8, 22075-22082
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Craig A. Kelly,David R. Rosseinsky Phys. Chem. Chem. Phys., 2001,3, 2086-2090
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Jason Wan Lab Chip, 2020,20, 4528-4538
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J. Matthew Kurley,Phillip W. Halstenberg,Abbey McAlister,Stephen Raiman,Richard T. Mayes RSC Adv., 2019,9, 25602-25608
84474-35-1 (Trichothec-9-ene-3,4,8,15-tetrol,12,13-epoxy-, 4,15-diacetate 8-(3-hydroxy-3-methylbutanoate), (3a,4b,8a)- (9CI)) Related Products
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