Sodium ion → N,10,13-trimethyl-17-(6-methylheptan-2-yl)-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-3-amine

HRID 2156944Notes

Reaction equation

HRID 2156944 reaction equation
[Al+3:32].[CH:1](=[O:2])[NH:3][CH:4]1[CH2:5][CH:6]2[CH2:7][CH2:8][CH:9]3[CH:10]4[CH2:11][CH2:12][CH:13]([CH:14]([CH2:15][CH2:16][CH2:17][CH:18]([CH3:19])[CH3:20])[CH3:21])[C:22]4([CH3:30])[CH2:23][CH2:24][CH:25]3[C:26]2([CH3:29])[CH2:27][CH2:28]1.[H-:31].[H-:34].[H-:35].[H-:36].[Li+:33].[Na+:37].[Na+:38].[O-:39][S:40](=[O:41])(=[O:42])[O-:43].[O:44]1[CH2:45][CH2:46][CH2:47][CH2:48]1>>[CH3:1][NH:3][CH:4]1[CH2:5][CH:6]2[CH2:7][CH2:8][CH:9]3[CH:10]4[CH2:11][CH2:12][CH:13]([CH:14]([CH2:15][CH2:16][CH2:17][CH:18]([CH3:19])[CH3:20])[CH3:21])[C:22]4([CH3:30])[CH2:23][CH2:24][CH:25]3[C:26]2([CH3:29])[CH2:27][CH2:28]1

Participants

8

Reactant 7

HCID 923Sodium ion2×HCID 1117Sulfate IonHCID 8028TetrahydrofuranHCID 28486Lithium ionHCID 104727Aluminum CationHCID 166653Hydride4×HCID 632867HCID 632867, compound

Product 1

HCID 19068841N,10,13-trimethyl-17-(6-methylheptan-2-yl)-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-3-amine

Sources & evidence

ORD record
ord-78c1075c4bc6482fa0cdbed83aa354dd
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (4/10)

Reaction notes

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