Water → 17-(5-hydroxypentan-2-yl)-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthrene-3,7-diol

HRID 1572186

Reaktionsgleichung

Reaktionsgleichung von HRID 1572186
[CH2:31]1[O:32][CH2:33][CH2:34][CH2:35]1.[CH3:1].[CH:2]12[CH2:3][CH:4]([OH:5])[CH2:6][CH2:7][C:8]1([CH3:9])[CH:10]1[CH2:11][CH2:12][C:13]3([CH3:14])[CH:15]([CH:23]([CH3:24])[CH2:25][CH2:26][C:27]([O-:28])=[O:29])[CH2:16][CH2:17][CH:18]3[CH:19]1[CH:20]([OH:21])[CH2:22]2.[OH2:30]>>[CH:2]12[CH2:3][CH:4]([OH:5])[CH2:6][CH2:7][C:8]1([CH3:9])[CH:10]1[CH2:11][CH2:12][C:13]3([CH3:14])[CH:15]([CH:23]([CH3:24])[CH2:25][CH2:26][CH2:27][OH:28])[CH2:16][CH2:17][CH:18]3[CH:19]1[CH:20]([OH:21])[CH2:22]2

Komponenten

5

Edukt 4

HCID 962WaterHCID 8028TetrahydrofuranHCID 3034819MethylHCID 219892625|A-Cholanic acid-3|A,7|A-diol

Produkt 1

HCID 1273137517-(5-hydroxypentan-2-yl)-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthrene-3,7-diol

Quellen und Nachweise

ORD-Eintrag
ord-6abac2a40bf34e679c03dc817aa809d0
Quelldatensatz
Training data from https://doi.org/10.1039/C8SC04228D (1/10)

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