HRID629839

反应详情

EQUATION

反应方程式

REACTANTS

反应物

结构：CO[C@@]12CC[C@@]3(C[C@@H]1[C@](C)(O)C(C)(C)C)[C@H]1Cc4ccc(O)c5c4[C@@]3(CCN1CC1CC1)[C@H]2O5

HCID9848990

未命名化合物

结构：CC(C)(C)[C@@](C)(O)[C@H]1C[C@@H]2[C@H]3Cc4c5c(c(O)c6c4[C@@]2(CCN3CC2CC2)[C@@H](O6)[C@H]1O)CC5

HCID86711659

未命名化合物

PRODUCTS

生成物

结构：CN1CC[C@]23c4c5c6c(c(O)c4O[C@H]2[C@@H](O)[C@@H]([C@](C)(O)C(C)(C)C)C[C@@H]3[C@H]1C5)CC6

HCID86711666

未命名化合物

收率 82.5%

PROCEDURE

实验过程

Compound 21 was synthesized similar to the procedure described in Example 1 for the preparation of compound 2 using compound 20 rather than compound 1. After isolation, 3.76 g of compound 21 (82.5%) was obtained with a purity of 92.7% as an off-white solid A sample was further purified by column chromatography to afford compound 21 in >99% purity as a white solid.

WORKUP

后处理

customCompound 21 was synthesized similar to the procedure

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-6923c86e02c0440fb666a0c68ae0e7a3
来源数据集: uspto-grants-2016_04
DOI: 10.6084/m9.figshare.5104873.v1
专利: US09315514B2
来源说明: uspto-grants-2016_04

反应 SMILES

C1([CH2:4][N:5]2[CH2:25][CH2:24][C@@:12]34[C:13]5[C:18]6[CH2:19][C@@H:6]2[C@H:7]3[CH2:8][C@H:9]([C@:27]([OH:33])([C:29]([CH3:32])([CH3:31])[CH3:30])[CH3:28])[C@H:10]([OH:26])[C@@H:11]4[O:23][C:14]=5[C:15]([OH:22])=[C:16]2[CH2:21][CH2:20][C:17]2=6)CC1.C[C@@](O)(C(C)(C)C)[C@@H]1[C@]2(OC)[C@@H]3OC4=C(O)C=CC5=C4[C@]43CCN(CC3CC3)[C@H](C5)[C@@]4(CC2)C1>>[CH3:30][C:29]([CH3:32])([CH3:31])[C@:27]([C@H:9]1[CH2:8][C@H:7]2[C@@:12]34[CH2:24][CH2:25][N:5]([CH3:4])[C@@H:6]2[CH2:19][C:18]2[C:13]3=[C:14]([O:23][C@H:11]4[C@H:10]1[OH:26])[C:15]([OH:22])=[C:16]1[CH2:21][CH2:20][C:17]1=2)([OH:33])[CH3:28]