Tetrahydrofuran → 4-(3-Hydroxy-10,13-dimethyl-hexadecahydro-cyclopenta[a]phenanthren-17-yl)-pentanoic Acid Octadecylamide

HRID 1153425

Reaction equation

[CH2:40]([CH2:41][CH2:42][CH2:43][CH2:44][CH2:45][CH2:46][CH2:47][CH2:48][CH2:49][CH2:50][CH2:51][CH2:52][CH2:53][CH2:54][CH2:55][CH2:56][CH3:57])[NH:58][CH2:59][CH2:60][CH2:61][CH2:62][CH2:63][CH2:64][CH2:65][CH2:66][CH2:67][CH2:68][CH2:69][CH2:70][CH2:71][CH2:72][CH2:73][CH2:74][CH2:75][CH3:76].[CH3:33][CH2:34][N:35]([CH2:36][CH3:37])[CH2:38][CH3:39].[CH:1]12[CH2:2][CH2:3][CH:4]3[CH:5]([CH2:6][CH2:7][C:8]4([CH3:9])[CH:10]([CH:14]([CH3:15])[CH2:16][CH2:17][C:18]([OH:19])=[O:20])[CH2:11][CH2:12][CH:13]34)[C:21]1([CH3:22])[CH2:23][CH2:24][CH:25]([OH:26])[CH2:27]2.[O:28]1[CH2:29][CH2:30][CH2:31][CH2:32]1>>[CH:1]12[CH2:2][CH2:3][CH:4]3[CH:5]([CH2:6][CH2:7][C:8]4([CH3:9])[CH:10]([CH:14]([CH3:15])[CH2:16][CH2:17][C:18](=[O:20])[NH:58][CH2:40][CH2:41][CH2:42][CH2:43][CH2:44][CH2:45][CH2:46][CH2:47][CH2:48][CH2:49][CH2:50][CH2:51][CH2:52][CH2:53][CH2:54][CH2:55][CH2:56][CH3:57])[CH2:11][CH2:12][CH:13]34)[C:21]1([CH3:22])[CH2:23][CH2:24][CH:25]([OH:26])[CH2:27]2

Participants

Reactant 4

HCID 8028Tetrahydrofuran

HCID 8471Triethylamine

HCID 66989Dioctadecylamine

HCID 5001654-(3-hydroxy-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-17-yl)pentanoic acid

Product 1

HCID 686366454-(3-Hydroxy-10,13-dimethyl-hexadecahydro-cyclopenta[a]phenanthren-17-yl)-pentanoic Acid Octadecylamide

Sources & evidence

ORD record: ord-1d5393b99df24dcbbb657163381bf073
Source dataset: Training data from https://doi.org/10.1039/C8SC04228D (7/10)
DOI: 10.1039/C8SC04228D

Linked notes

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