| 货号 (SKU) | 包装规格 | 是否现货 | 价格 | 数量 |
|---|---|---|---|---|
| D107312-20mg |
20mg |
现货  |
|
| 别名 | 10-去乙酰基巴卡亭,10-DAB |
|---|---|
| 英文别名 | (2aR,4S,4aS,6R,9S,11S,12S,12aR,12bS)-12b-acetoxy-4,6,9,11-tetrahydroxy-4a,8,13,13-tetramethyl-5-oxo-2a,3,4,4a,5,6,9,10,11,12,12a,12b-dodecahydro-1H-7,11-methanocyclodeca[3,4]benzo[1,2-b]oxet-12-yl benzoate | MLS006011993 | SMR004703546 | BRD-K96631475-001 |
| 规格或纯度 | 分析标准品, ≥98% |
| 英文名称 | 10-Deacetylbaccatin III |
| 生化机理 | 10-Deacetylbaccatin-III 是紫杉醇类似物制剂的中间体。紫杉醇具有抗肿瘤作用。其中几种紫杉醇可由 10-去乙酰巴卡丁-III合成。10-Deacetylbaccine III 是紫杉醇生物合成的第五个中间体。该生物合成途径包括约 20 个酶解步骤，但尚未完全阐明。10-Deacetylbaccine III 是一种抗肿瘤药物和抗癌中间体。 |
| 应用 | 紫杉醇及其衍生物的合成中间体。 |
| 储存温度 | 2-8°C储存 |
| 运输条件 | 冰袋运输 |
| 产品介绍 |
不溶于水，溶于甲醇、丙酮和吡啶。 紫杉醇及其衍生物的合成中间体。 |
| 活性类型 | Relation | Activity value | Units | Action Type | Journal | PubMed Id | doi | Assay Aladdin ID |
|---|
| 活性类型 | Relation | Activity value | Units | Action Type | Journal | PubMed Id | doi | Assay Aladdin ID |
|---|
| 作用机制 | Action Type | target ID | Target Name | Target Type | Target Organism | Binding Site Name | 参考文献 |
|---|
| 分子类型 | 小分子 |
|---|---|
| IUPAC Name | [(1S,2S,3R,4S,7R,9S,10S,12R,15S)-4-acetyloxy-1,9,12,15-tetrahydroxy-10,14,17,17-tetramethyl-11-oxo-6-oxatetracyclo[11.3.1.03,10.04,7]heptadec-13-en-2-yl] benzoate |
| INCHI | InChI=1S/C29H36O10/c1-14-17(31)12-29(36)24(38-25(35)16-9-7-6-8-10-16)22-27(5,23(34)21(33)20(14)26(29,3)4)18(32)11-19-28(22,13-37-19)39-15(2)30/h6-10,17-19,21-22,24,31-33,36H,11-13H2,1-5H3/t17-,18-,19+,21+,22-,24-,27+,28-,29+/m0/s1 |
| InChi Key | YWLXLRUDGLRYDR-ZHPRIASZSA-N |
| Canonical SMILES | CC1=C2C(C(=O)C3(C(CC4C(C3C(C(C2(C)C)(CC1O)O)OC(=O)C5=CC=CC=C5)(CO4)OC(=O)C)O)C)O |
| Isomeric SMILES | CC1=C2[C@H](C(=O)[C@@]3([C@H](C[C@@H]4[C@]([C@H]3[C@@H]([C@@](C2(C)C)(C[C@@H]1O)O)OC(=O)C5=CC=CC=C5)(CO4)OC(=O)C)O)C)O |
| WGK Germany | 3 |
| PubChem CID | 154272 |
| 分子量 | 544.59 |
| Reaxy-Rn | 1445248 |
| 密度 | 1.41 |
|---|---|
| 比旋光度 | -42° (C=1,MeOH) |
| 熔点 | 231-236°C |
| 分子量 | 544.600 g/mol |
| XLogP3 | 0.600 |
| 氢键供体数Hydrogen Bond Donor Count | 4 |
| 氢键受体数Hydrogen Bond Acceptor Count | 10 |
| 可旋转键计数Rotatable Bond Count | 5 |
| 精确质量Exact Mass | 544.231 Da |
| 单同位素质量Monoisotopic Mass | 544.231 Da |
| 拓扑极表面积Topological Polar Surface Area | 160.000 Ų |
| 重原子数Heavy Atom Count | 39 |
| 形式电荷Formal Charge | 0 |
| 复杂度Complexity | 1090.000 |
| 同位素原子数Isotope Atom Count | 0 |
| 定义的原子立体中心计数Defined Atom Stereocenter Count | 9 |
| 未定义的原子立体中心计数Undefined Atom Stereocenter Count | 0 |
| 定义的键立体中心计数Defined Bond Stereocenter Count | 0 |
| 未定义的键立体中心计数Undefined Bond Stereocenter Count | 0 |
| 所有立体化学键的总数The total count of all stereochemical bonds | 0 |
| 共价键合单元计数Covalently-Bonded Unit Count | 1 |
| 象形图 | GHS06, GHS08, GHS07 |
|---|---|
| 信号词 | Danger |
| 危险声明 |
H315: 引起皮肤刺激 H319: 引起严重眼睛刺激 H335: 可能引起呼吸道刺激 H301: 吞咽会中毒 H311: 皮肤接触有毒 H331: 吸入会中毒 H373: 通过长时间或反复暴露对器官造成损害 H412: 对水生生物有害并具有长期持续影响 H340: 可能导致遗传缺陷 H350: 可能导致癌症 |
| 预防措施声明 |
P261: 避免吸入灰尘/烟雾/气体/雾/蒸汽/喷雾 P305+P351+P338: 如进入眼睛：用水小心冲洗几分钟。如戴隐形眼镜并可方便地取出，取出隐形眼镜。继续冲洗。 P273: 避免释放到环境中。 P280: 戴防护手套/穿防护服/戴防护眼罩/戴防护面具。 P302+P352: 如皮肤沾染：用水充分清洗。 P321: 特殊处理（请参阅此标签上的...）。 P405: 密闭存放 P501: 将内容物/容器处理到。。。 P264: 处理后要彻底洗手。 P260: 不要吸入灰尘/烟雾/气体/雾/蒸汽/喷雾。 P281: 根据需要使用个人防护设备。 P271: 仅在室外或通风良好的地方使用。 P270: 使用本产品时，请勿进食、饮水或吸烟。 P304+P340: 如误吸入：将人转移到空气新鲜处，保持呼吸舒适体位。 P403+P233: 存放在通风良好的地方。保持容器密闭。 P362+P364: 脱掉沾污的衣服，清洗后方可重新使用。 P330: 漱口 P361+P364: 立即脱掉所有沾染的衣服，清洗后方可重新使用。 P203: 使用前，获取、阅读并遵守所有安全说明。 P264+P265: 处理后彻底洗手[和…]。不要触摸眼睛。 P301+P316: 如果吞咽：立即寻求紧急医疗救助。 P318: 如果暴露或担心，请就医。 P337+P317: 如果眼睛刺激持续：寻求医疗帮助。 P332+P317: 如果出现皮肤刺激：请寻求医疗帮助。 P316: 立即寻求紧急医疗救助。 P319: 如果你感到不适，请寻求医疗帮助。 |
| WGK Germany | 3 |
| Reaxy-Rn | 1445248 |
| 个人防护装备 | Eyeshields,Gloves,type N95 (US),type P1 (EN143) respirator filter |
| 1. Hao Li, Wenbo Xie, Lei Zeng, Wen Li, Boan Shi, Fuhou Lei. (2022) Development and evaluation of a hydrogenated rosin (β-acryloxyl ethyl) ester–bonded silica stationary phase for high-performance liquid chromatography separation of paclitaxel from yew bark. JOURNAL OF CHROMATOGRAPHY A, 1665 (462815). [PMID:35038614] [10.1016/j.chroma.2022.462815] |
| 2. Jia Gao, Li Chen, Yongsheng Yan, Jian Lu, Wendong Xing, Jiangdong Dai, Minjia Meng, Yilin Wu. (2021) Dot-matrix-initiated molecularly imprinted nanocomposite membranes for selective recognition: a high-efficiency separation system with an anti-oil fouling layer. Environmental Science-Nano, 8 (10): (2932-2949). [10.1039/D1EN00296A] |
| 3. Bi Wang, Shu Xu, Yan Cao, Fei Liu, Xingzeng Zhao, Xu Feng. (2018) Fungicidal activity of 10-deacetylbacatin III against Phytophthora capsici via inhibiting lysine biosynthesis. PESTICIDE BIOCHEMISTRY AND PHYSIOLOGY, 152 (114). [PMID:30497701] [10.1016/j.pestbp.2018.09.008] |
| 4. Yu Chunna, Luo Xiujun, Zhan Xiaori, Hao Juan, Zhang Lei, L Song Yao-Bin, Shen Chenjia, Dong Ming. (2018) Comparative metabolomics reveals the metabolic variations between two endangered Taxus species (T. fuana and T. yunnanensis) in the Himalayas. BMC PLANT BIOLOGY, 18 (1): (1-12). [PMID:30223770] [10.1186/s12870-018-1412-4] |
| 5. Hao Juan, Guo Hong, Shi Xinai, Wang Ye, Wan Qinghua, Song Yao-Bin, Zhang Lei, Dong Ming, Shen Chenjia. (2017) Comparative proteomic analyses of two Taxus species (Taxus × media and Taxus mairei) reveals variations in the metabolisms associated with paclitaxel and other metabolites. PLANT AND CELL PHYSIOLOGY, 58 (11): (1878-1890). [PMID:29016978] [10.1093/pcp/pcx128] |
| 6. Yu Chunna, Guo Hong, Zhang Yangyang, Song Yaobin, Pi Erxu, Yu Chenliang, Zhang Lei, Dong Ming, Zheng Bingsong, Wang Huizhong, Shen Chenjia. (2017) Identification of potential genes that contributed to the variation in the taxoid contents between two Taxus species (Taxus media and Taxus mairei). TREE PHYSIOLOGY, 37 (12): (1659-1671). [PMID:28985439] [10.1093/treephys/tpx091] |
| 1. Hao Li, Wenbo Xie, Lei Zeng, Wen Li, Boan Shi, Fuhou Lei. (2022) Development and evaluation of a hydrogenated rosin (β-acryloxyl ethyl) ester–bonded silica stationary phase for high-performance liquid chromatography separation of paclitaxel from yew bark. JOURNAL OF CHROMATOGRAPHY A, 1665 (462815). [PMID:35038614] [10.1016/j.chroma.2022.462815] |
| 2. Jia Gao, Li Chen, Yongsheng Yan, Jian Lu, Wendong Xing, Jiangdong Dai, Minjia Meng, Yilin Wu. (2021) Dot-matrix-initiated molecularly imprinted nanocomposite membranes for selective recognition: a high-efficiency separation system with an anti-oil fouling layer. Environmental Science-Nano, 8 (10): (2932-2949). [10.1039/D1EN00296A] |
| 3. Bi Wang, Shu Xu, Yan Cao, Fei Liu, Xingzeng Zhao, Xu Feng. (2018) Fungicidal activity of 10-deacetylbacatin III against Phytophthora capsici via inhibiting lysine biosynthesis. PESTICIDE BIOCHEMISTRY AND PHYSIOLOGY, 152 (114). [PMID:30497701] [10.1016/j.pestbp.2018.09.008] |
| 4. Yu Chunna, Luo Xiujun, Zhan Xiaori, Hao Juan, Zhang Lei, L Song Yao-Bin, Shen Chenjia, Dong Ming. (2018) Comparative metabolomics reveals the metabolic variations between two endangered Taxus species (T. fuana and T. yunnanensis) in the Himalayas. BMC PLANT BIOLOGY, 18 (1): (1-12). [PMID:30223770] [10.1186/s12870-018-1412-4] |
| 5. Hao Juan, Guo Hong, Shi Xinai, Wang Ye, Wan Qinghua, Song Yao-Bin, Zhang Lei, Dong Ming, Shen Chenjia. (2017) Comparative proteomic analyses of two Taxus species (Taxus × media and Taxus mairei) reveals variations in the metabolisms associated with paclitaxel and other metabolites. PLANT AND CELL PHYSIOLOGY, 58 (11): (1878-1890). [PMID:29016978] [10.1093/pcp/pcx128] |
| 6. Yu Chunna, Guo Hong, Zhang Yangyang, Song Yaobin, Pi Erxu, Yu Chenliang, Zhang Lei, Dong Ming, Zheng Bingsong, Wang Huizhong, Shen Chenjia. (2017) Identification of potential genes that contributed to the variation in the taxoid contents between two Taxus species (Taxus media and Taxus mairei). TREE PHYSIOLOGY, 37 (12): (1659-1671). [PMID:28985439] [10.1093/treephys/tpx091] |
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