HRID315586

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID313

Hydrochloric Acid

ClH

HCID787

Hydroxylamine

H3NO

结构：CCC1OC(=O)C(C)C(OC2CC(C)(OC)C(O)C(C)O2)C(C)C(OC2OC(C)CC(N(C)C)C2O)C(C)(O)CC(C)C(=O)C(C)C(O)C1(C)O

HCID3255

6-{[4-(Dimethylamino)-3-hydroxy-6-methyloxan-2-yl]oxy}-14-ethyl-7,12,13-trihydroxy-4-[(5-hydroxy-4-methoxy-4,6-dimethyloxan-2-yl)oxy]-3,5,7,9,11,13-hexamethyl-1-oxacyclotetradecane-2,10-dione

C37H67NO13

PRODUCTS

生成物

HCID945

Nitroxyl

HNO

HCID3255

6-{[4-(Dimethylamino)-3-hydroxy-6-methyloxan-2-yl]oxy}-14-ethyl-7,12,13-trihydroxy-4-[(5-hydroxy-4-methoxy-4,6-dimethyloxan-2-yl)oxy]-3,5,7,9,11,13-hexamethyl-1-oxacyclotetradecane-2,10-dione

C37H67NO13

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-6d20a332787f4eb8a74c97be82e8c967
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (8/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (8/10)

反应 SMILES

[CH3:1][CH2:2][CH:3]1[O:4][C:5](=[O:6])[CH:7]([CH3:8])[CH:9]([O:10][CH:11]2[CH2:12][C:13]([CH3:14])([O:15][CH3:16])[CH:17]([OH:18])[CH:19]([CH3:20])[O:21]2)[CH:22]([CH3:23])[CH:24]([O:25][CH:26]2[O:27][CH:28]([CH3:29])[CH2:30][CH:31]([N:34]([CH3:35])[CH3:36])[CH:32]2[OH:33])[C:37]([CH3:38])([OH:39])[CH2:40][CH:41]([CH3:42])[C:43](=[O:44])[CH:45]([CH3:46])[CH:47]([OH:48])[C:49]1([CH3:50])[OH:51].[ClH:52].[NH2:53][OH:54]>>[CH3:1][CH2:2][CH:3]1[O:4][C:5](=[O:6])[CH:7]([CH3:8])[CH:9]([O:10][CH:11]2[CH2:12][C:13]([CH3:14])([O:15][CH3:16])[CH:17]([OH:18])[CH:19]([CH3:20])[O:21]2)[CH:22]([CH3:23])[CH:24]([O:25][CH:26]2[O:27][CH:28]([CH3:29])[CH2:30][CH:31]([N:34]([CH3:35])[CH3:36])[CH:32]2[OH:33])[C:37]([CH3:38])([OH:39])[CH2:40][CH:41]([CH3:42])[C:43](=[O:44])[CH:45]([CH3:46])[CH:47]([OH:48])[C:49]1([CH3:50])[OH:51].[NH:53]=[O:54]