Cas no 535-96-6 (Marein)
Marein structure
Product Name:Marein
CAS No:535-96-6
MF:C21H22O11
MW:450.392787456512
MDL:MFCD00017496
CID:371545
PubChem ID:6441269
Update Time:2025-04-19
Marein Chemical and Physical Properties
Names and Identifiers
-
- 2-Propen-1-one,3-(3,4-dihydroxyphenyl)-1-[4-(b-D-glucopyranosyloxy)-2,3-dihydroxyphenyl]-, (2E)-
- MAREIN
- 2-Propen-1-one,3-(3,4-dihydroxyphenyl)-1-[4-(b-D-glucopyranosyloxy)-2,3-dihydroxyphenyl]-, (2E...
- MAREIN(SH)
- 2',3,3',4,4'-PENTAHYDROXY-4'-GLUCOSYLCHALCONE
- OKANIN-4'-O-GLUCOSIDE
- CS-0135183
- CHALCONE, 2',3,3',4,4'-PENTAHYDROXY-, 4'-.BETA.-D-GLUCOPYRANOSIDE
- NCGC00163591-01
- EINECS 208-623-1
- DTXSID601029273
- Marein with hplc
- (E)-3-(3,4-dihydroxyphenyl)-1-[2,3-dihydroxy-4-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyphenyl]prop-2-en-1-one
- (E)-1-(2,3-Dihydroxy-4-(((2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-2-yl)oxy)phenyl)-3-(3,4-dihydroxyphenyl)prop-2-en-1-one
- 2-Propen-1-one, 3-(3,4-dihydroxyphenyl)-1-(4-(beta-D-glucopyranosyloxy)-2,3-dihydroxyphenyl)-, (E)-
- 3-(3,4-DIHYDROXYPHENYL)-1-(4-(.BETA.-D-GLUCOPYRANOSYLOXY)-2,3-DIHYDROXYPHENYL)-2-PROPEN-1-ONE
- (2E)-3-(3,4-DIHYDROXYPHENYL)-1-(4-(.BETA.-D-GLUCOPYRANOSYLOXY)-2,3-DIHYDROXYPHENYL)-2-PROPEN-1-ONE
- D85182
- Q15426199
- CHEBI:179868
- (E)-3-(3,4-Dihydroxyphenyl)-1-(4-(beta-D-glucopyranosyloxy)-2,3-dihydroxyphenyl)-2-propen-1-one
- CHEMBL490510
- SCHEMBL620953
- SR-05000002270-2
- NS00043567
- SR-05000002270
- (E)-1-(2,3-dihydroxy-4-((2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-2-yloxy)phenyl)-3-(3,4-dihydroxyphenyl)prop-2-en-1-one
- CY787E65J4
- 2-PROPEN-1-ONE, 3-(3,4-DIHYDROXYPHENYL)-1-(4-(.BETA.-D-GLUCOPYRANOSYLOXY)-2,3-DIHYDROXYPHENYL)-
- AKOS040760542
- BDBM50250286
- MS-28160
- MFCD00017496
- CCG-208403
- 535-96-6
- UNII-CY787E65J4
- OKANIN 4'-O-.BETA.-D-GLUCOPYRANOSIDE
- 2-PROPEN-1-ONE, 3-(3,4-DIHYDROXYPHENYL)-1-(4-(.BETA.-D-GLUCOPYRANOSYLOXY)-2,3-DIHYDROXYPHENYL)-, (E)-
- HY-N7676
- (E)-3-(3,4-dihydroxyphenyl)-1-[2,3-dihydroxy-4-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyphenyl]prop-2-en-1-one
- okanin-4'-O-beta-glucopyranoside
- (E)-3-(3,4-dihydroxyphenyl)-1-(2,3-dihydroxy-4-(3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl)oxyphenyl)prop-2-en-1-one
- (E)-3-(3,4-dihydroxyphenyl)-1-(2,3-dihydroxy-4-((2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl)oxyphenyl)prop-2-en-1-one
- Marein
-
- MDL： MFCD00017496
- Inchi： 1S/C21H22O11/c22-8-15-18(28)19(29)20(30)21(32-15)31-14-6-3-10(16(26)17(14)27)11(23)4-1-9-2-5-12(24)13(25)7-9/h1-7,15,18-22,24-30H,8H2/b4-1+/t15-,18-,19+,20-,21-/m1/s1
- InChI Key： XGEYXJDOVMEJNG-HTFDPZBKSA-N
- SMILES： O1[C@H]([C@@H]([C@H]([C@@H]([C@H]1CO)O)O)O)OC1C=CC(C(/C=C/C2C=CC(=C(C=2)O)O)=O)=C(C=1O)O
Computed Properties
- Exact Mass: 450.11600
- Monoisotopic Mass: 450.11621151 g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 8
- Hydrogen Bond Acceptor Count: 11
- Heavy Atom Count: 32
- Rotatable Bond Count: 6
- Complexity: 658
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 5
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 1
- Undefined Bond Stereocenter Count: 0
- Molecular Weight: 450.4
- XLogP3: 0.7
- Topological Polar Surface Area: 197?2
Experimental Properties
- Color/Form: Yellow powder
- Melting Point: 197-202°C
- PSA: 197.37000
- LogP: -0.41620
Marein Pricemore >>
| Related Categories | No. | Product Name | Cas No. | Purity | Specification | Price | update time | Inquiry |
|---|---|---|---|---|---|---|---|---|
| TRC | M214060-0.5mg |
Marein |
535-96-6 | 0.5mg |
$ 70.00 | 2022-06-04 | ||
| TRC | M214060-1mg |
Marein |
535-96-6 | 1mg |
$ 50.00 | 2022-06-04 | ||
| abcr | AB253839-5 mg |
Marein; 99%, delivered with HPLC chromatogram |
535-96-6 | 5 mg |
€220.00 | 2023-07-20 | ||
| Chengdu Biopurify Phytochemicals Ltd | BP2136-10mg |
Marein |
535-96-6 | 98% | 10mg |
$160 | 2023-09-19 | |
| Chengdu Biopurify Phytochemicals Ltd | BP2136-20mg |
Marein |
535-96-6 | 98% | 20mg |
$290 | 2023-09-19 | |
| ChemScence | CS-0135183-5mg |
Marein |
535-96-6 | 99.49% | 5mg |
$250.0 | 2022-04-27 | |
| SHANG HAI JI ZHI SHENG HUA Technology Co., Ltd. | M61770-5mg |
MAREIN |
535-96-6 | 5mg |
￥2198.0 | 2021-09-08 | ||
| SHANG HAI TAO SHU Biotechnology Co., Ltd. | TN1911-1 mg |
Marein |
535-96-6 | 99.12% | 1mg |
￥987.00 | 2022-04-26 | |
| SHANG HAI TAO SHU Biotechnology Co., Ltd. | TN1911-5 mg |
Marein |
535-96-6 | 99.12% | 5mg |
￥2217.00 | 2022-04-26 | |
| SHANG HAI TAO SHU Biotechnology Co., Ltd. | TN1911-10 mg |
Marein |
535-96-6 | 99.12% | 10mg |
￥3325.00 | 2022-04-26 |
Marein Related Literature
-
Jason Wan Lab Chip, 2020,20, 4528-4538
-
Yi Cao,Yujiao Xiahou,Lixiang Xing,Xiang Zhang,Hong Li,ChenShou Wu,Haibing Xia Nanoscale, 2020,12, 20456-20466
-
Gang Pan,Yi-jie Bao,Jie Xu,Tao Liu,Cheng Liu,Yan-yan Qiu,Xiao-jing Shi,Hui Yu,Ting-ting Jia,Xia Yuan,Ze-ting Yuan,Yi-jun Cao RSC Adv., 2016,6, 42109-42119
-
Manickam Bakthadoss,Tadiparthi Thirupathi Reddy,Vishal Agarwal,Duddu S. Sharada Chem. Commun., 2022,58, 1406-1409
-
Zhixia Liu,Tingjian Chen,Floyd E. Romesberg Chem. Sci., 2017,8, 8179-8182
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