Hydrochloric Acid → HCID 178496379, 화합물

HRID 2329488

반응식

HRID 2329488 반응식
[CH2:34]([CH:35]([CH2:36][CH2:37][CH2:38][CH3:39])[C:40]([O-:41])=[O:42])[CH3:43].[CH2:45]1[O:46][CH2:47][CH2:48][CH2:49]1.[CH:1]1([CH:6]=[CH:7][CH:8]([OH:9])[CH:10]2[CH:11]([OH:18])[CH:12]([O:16][CH3:17])[C:13](=[O:15])[O:14]2)[CH2:2][CH2:3][CH2:4][CH2:5]1.[ClH:19].[NH2:20][CH:21]1[C:22](=[O:33])[N:23]([CH3:32])[c:24]2[c:25]([cH:28][cH:29][cH:30][cH:31]2)[CH2:26][CH2:27]1.[Na+:44]>>[CH:1]1([CH:6]=[CH:7][CH:8]([OH:9])[CH:10]([CH:11]([CH:12]([C:13](=[O:15])[NH:20][CH:21]2[C:22](=[O:33])[N:23]([CH3:32])[c:24]3[c:25]([cH:28][cH:29][cH:30][cH:31]3)[CH2:26][CH2:27]2)[O:16][CH3:17])[OH:18])[OH:14])[CH2:2][CH2:3][CH2:4][CH2:5]1

참가 물질

7

반응물 6

HCID 313Hydrochloric AcidHCID 923Sodium ionHCID 8028TetrahydrofuranHCID 40723562-EthylhexanoateHCID 139244393-Amino-1-methyl-4,5-dihydro-1H-benzo[b]azepin-2(3H)-oneHCID 178493942HCID 178493942, 화합물

생성물 1

HCID 178496379HCID 178496379, 화합물

출처 및 근거

ORD 기록
ord-5f359d0148fe49e89c9ee6566a035a1c
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (10/10)

연결된 노트

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