Cas no 95258-17-6 (methyl (11beta,12alpha,13xi,15beta)-15-{[(2E)-4-(acetyloxy)-3,4-dimethylpent-2-enoyl]oxy}-2-(beta-D-glucopyranosyloxy)-11,12-dihydroxy-3,16-dioxo-13,20-epoxypicras-1-en-21-oate)
![methyl (11beta,12alpha,13xi,15beta)-15-{[(2E)-4-(acetyloxy)-3,4-dimethylpent-2-enoyl]oxy}-2-(beta-D-glucopyranosyloxy)-11,12-dihydroxy-3,16-dioxo-13,20-epoxypicras-1-en-21-oate structure](https://ossimg.kuujia.com/scimg/95500/95258-17-6x500.png)
95258-17-6 structure
Product Name:methyl (11beta,12alpha,13xi,15beta)-15-{[(2E)-4-(acetyloxy)-3,4-dimethylpent-2-enoyl]oxy}-2-(beta-D-glucopyranosyloxy)-11,12-dihydroxy-3,16-dioxo-13,20-epoxypicras-1-en-21-oate
CAS No:95258-17-6
MF:C36H48O18
MW:768.755533218384
CID:1987579
PubChem ID:101659161
Update Time:2024-12-09
methyl (11beta,12alpha,13xi,15beta)-15-{[(2E)-4-(acetyloxy)-3,4-dimethylpent-2-enoyl]oxy}-2-(beta-D-glucopyranosyloxy)-11,12-dihydroxy-3,16-dioxo-13,20-epoxypicras-1-en-21-oate Chemical and Physical Properties
Names and Identifiers
-
- methyl (11beta,12alpha,13xi,15beta)-15-{[(2E)-4-(acetyloxy)-3,4-dimethylpent-2-enoyl]oxy}-2-(beta-D-glucopyranosyloxy)-11,12-dihydroxy-3,16-dioxo-13,20-epoxypicras-1-en-21-oate
- methyl (11beta,12alpha,13xi,15beta)-15-{[(2E)-4-(acetyloxy)-3,4-dimethylpent-2-enoyl]oxy}-2-(beta-D-glucopyranosyloxy)-11,12-
- Yadanzioside G
- 2H-3,11c-(Epoxymethano)phenanthro[10,1-bc]pyran, picras-1-en-21-oic acid deriv. (ZCI)
- Picras-1-en-21-oic acid, 15-[[(2E)-4-(acetyloxy)-3,4-dimethyl-1-oxo-2-pentenyl]oxy]-13,20-epoxy-2-(β-D-glucopyranosyloxy)-11,12-dihydroxy-3,16-dioxo-, methyl ester, (11β,12α,15β)- (9CI)
- D
- FS-8792
- 95258-17-6
- AKOS040760762
- HY-N7191
- CS-0104647
- DA-68759
- Picras-1-en-21-oic acid, 15-[(3,4-dimethyl-1-oxo-2-pentenyl)oxy]-13,20-epoxy-2-(.beta.-D-glucopyranosyloxy)-11,12-dihydroxy-3,16-dioxo-, (11.beta.,12.alpha.,15.beta.)-
- Yadanzioside-G
- methyl (1R,2S,3R,6R,8S,9S,13S,14R,15R,16S)-3-[(E)-4-acetyloxy-3,4-dimethylpent-2-enoyl]oxy-15,16-dihydroxy-9,13-dimethyl-4,10-dioxo-11-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-5,18-dioxapentacyclo[12.5.0.01,6.02,17.08,13]nonadec-11-ene-17-carboxylate
-
- Inchi： 1S/C36H48O18/c1-13(33(4,5)54-15(3)38)8-20(39)53-26-28-35-12-49-36(28,32(47)48-7)29(45)25(44)27(35)34(6)10-17(21(40)14(2)16(34)9-19(35)52-30(26)46)50-31-24(43)23(42)22(41)18(11-37)51-31/h8,10,14,16,18-19,22-29,31,37,41-45H,9,11-12H2,1-7H3/b13-8+/t14-,16-,18+,19+,22+,23-,24+,25+,26+,27+,28+,29-,31+,34-,35+,36-/m0/s1
- InChI Key： YNYBTCKMNHXXGZ-CYIYFLOKSA-N
- SMILES： C([C@]12OC[C@]34[C@H](OC([C@@H]([C@@H]13)OC(=O)/C=C(\C)/C(C)(C)OC(=O)C)=O)C[C@H]1[C@@H](C(C(=C[C@]1(C)[C@H]4[C@H]([C@@H]2O)O)O[C@H]1[C@H](O)[C@@H](O)[C@H](O)[C@@H](CO)O1)=O)C)(=O)OC
Computed Properties
- Exact Mass: 768.28406468g/mol
- Monoisotopic Mass: 768.28406468g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 6
- Hydrogen Bond Acceptor Count: 18
- Heavy Atom Count: 54
- Rotatable Bond Count: 11
- Complexity: 1650
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 16
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 1
- Undefined Bond Stereocenter Count: 0
- XLogP3: 0.1
- Topological Polar Surface Area: 271?2
Experimental Properties
- Color/Form: Powder
- Density: 1.5±0.1 g/cm3
- Boiling Point: 948.1±65.0 °C at 760 mmHg
- Flash Point: 291.3±27.8 °C
- Vapor Pressure: 0.0±0.6 mmHg at 25°C
methyl (11beta,12alpha,13xi,15beta)-15-{[(2E)-4-(acetyloxy)-3,4-dimethylpent-2-enoyl]oxy}-2-(beta-D-glucopyranosyloxy)-11,12-dihydroxy-3,16-dioxo-13,20-epoxypicras-1-en-21-oate Security Information
- Hazard Statement： H303May be harmful if swallowed+H313Skin contact may be harmful+H333Inhalation may be harmful to the body
- Warning Statement： P264+P280+P305+P351+P338+P337+P313
- Safety Instruction： H303+H313+H333
- Storage Condition：Store at 4 ℃, better at -4 ℃
methyl (11beta,12alpha,13xi,15beta)-15-{[(2E)-4-(acetyloxy)-3,4-dimethylpent-2-enoyl]oxy}-2-(beta-D-glucopyranosyloxy)-11,12-dihydroxy-3,16-dioxo-13,20-epoxypicras-1-en-21-oate Pricemore >>
| Related Categories | No. | Product Name | Cas No. | Purity | Specification | Price | update time | Inquiry |
|---|---|---|---|---|---|---|---|---|
| SHANG HAI TAO SHU Biotechnology Co., Ltd. | TN2320-5 mg |
Yadanzioside G |
95258-17-6 | 5mg |
￥4336.00 | 2022-04-26 | ||
| SHANG HAI JI ZHI SHENG HUA Technology Co., Ltd. | Y97990-5 mg |
methyl (11beta,12alpha,13xi,15beta)-15-{[(2E)-4-(acetyloxy)-3,4-dimethylpent-2-enoyl]oxy}-2-(beta-D-glucopyranosyloxy)-11,12-dihydroxy-3,16-dioxo-13,20-epoxypicras-1-en-21-oate |
95258-17-6 | 5mg |
￥5760.0 | 2021-09-07 | ||
| ChemFaces | CFN96422-5mg |
Yadanzioside G |
95258-17-6 | >=93% | 5mg |
$413 | 2023-09-19 | |
| ChemFaces | CFN96422-5mg |
Yadanzioside G |
95258-17-6 | >=93% | 5mg |
$413 | 2021-07-22 | |
| SHANG HAI JI ZHI SHENG HUA Technology Co., Ltd. | Y97990-5mg |
methyl (11beta,12alpha,13xi,15beta)-15-{[(2E)-4-(acetyloxy)-3,4-dimethylpent-2-enoyl]oxy}-2-(beta-D-glucopyranosyloxy)-11,12-dihydroxy-3,16-dioxo-13,20-epoxypicras-1-en-21-oate |
95258-17-6 | ,98.0% | 5mg |
￥5760.0 | 2023-09-05 | |
| TargetMol Chemicals | TN2320-5 mg |
Yadanzioside G |
95258-17-6 | 98% | 5mg |
￥ 4,040 | 2023-07-10 | |
| TargetMol Chemicals | TN2320-1 mL * 10 mM (in DMSO) |
Yadanzioside G |
95258-17-6 | 98% | 1 mL * 10 mM (in DMSO) |
￥ 6150 | 2023-09-15 | |
| TargetMol Chemicals | TN2320-5mg |
Yadanzioside G |
95258-17-6 | 5mg |
￥ 4040 | 2024-07-19 | ||
| TargetMol Chemicals | TN2320-1 ml * 10 mm |
Yadanzioside G |
95258-17-6 | 1 ml * 10 mm |
￥ 6150 | 2024-07-19 |
methyl (11beta,12alpha,13xi,15beta)-15-{[(2E)-4-(acetyloxy)-3,4-dimethylpent-2-enoyl]oxy}-2-(beta-D-glucopyranosyloxy)-11,12-dihydroxy-3,16-dioxo-13,20-epoxypicras-1-en-21-oate Related Literature
-
Christopher J. Harrison,Kyle J. Berean,Enrico Della Gaspera,Jian Zhen Ou,Richard B. Kaner,Kourosh Kalantar-zadeh,Torben Daeneke Nanoscale, 2016,8, 16276-16283
-
Xing Zhao,Lu Bai,Rui-Ying Bao,Zheng-Ying Liu,Ming-Bo Yang,Wei Yang RSC Adv., 2017,7, 46297-46305
-
Ivor Lon?ari? Phys. Chem. Chem. Phys., 2015,17, 9436-9445
-
Xiaotong Feng,Lei Bian,Jie Ma,Lei Zhou,Xiayan Wang,Guangsheng Guo,Qiaosheng Pu Chem. Commun., 2019,55, 3963-3966
95258-17-6 (methyl (11beta,12alpha,13xi,15beta)-15-{[(2E)-4-(acetyloxy)-3,4-dimethylpent-2-enoyl]oxy}-2-(beta-D-glucopyranosyloxy)-11,12-dihydroxy-3,16-dioxo-13,20-epoxypicras-1-en-21-oate) Related Products
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