HCID 14860771, 화합물 → HCID 178460428, 화합물

반응식

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

참가 물질

반응물 2

HCID 14860771HCID 14860771, 화합물

HCID 178460429HCID 178460429, 화합물

생성물 1

HCID 178460428HCID 178460428, 화합물

출처 및 근거

ORD 기록: ord-99a44c3088e84259b62602187b2e8cfd
출처 데이터셋: Training data from https://doi.org/10.1039/C8SC04228D (5/10)
DOI: 10.1039/C8SC04228D

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