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Bicarbonate Ion → HCID 178460418, compound

HRID 175246
Notes
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Reaction equation

HRID 175246 reaction equation
[C:44](=[O:45])([OH:46])[O-:47].[CH2:27]([O:29][C:30]([O:28][CH2:33][CH3:34])([CH2:31][CH3:32])[O:35][CH2:36][CH3:37])[CH3:38].[CH2:49]1[O:50][CH2:51][CH2:52][CH2:53]1.[K+:48].[OH2:54].[OH:1][C:2]1([C:3]([CH2:4][OH:5])=[O:6])[CH:7]([CH3:26])[CH2:8][CH:9]2[CH:10]3[CH2:11][CH2:12][C:13]4=[CH:14][C:15](=[O:25])[CH:16]=[CH:17][C:18]4([CH3:19])[C:20]3=[CH:21][CH2:22][C:23]12[CH3:24].[S:39](=[O:40])(=[O:41])([OH:42])[OH:43]>>[O:1]([C:2]1([C:3]([CH2:4][OH:5])=[O:6])[CH:7]([CH3:26])[CH2:8][CH:9]2[CH:10]3[CH2:11][CH2:12][C:13]4=[CH:14][C:15](=[O:25])[CH:16]=[CH:17][C:18]4([CH3:19])[C:20]3=[CH:21][CH2:22][C:23]12[CH3:24])[C:30](=[O:29])[CH2:31][CH3:32]
ParticipantsSources & evidenceReaction notes

Participants

8

Reactant 7

HCID 769Bicarbonate IonHCID 813Potassium CationHCID 962WaterHCID 1118Sulfuric AcidHCID 8028TetrahydrofuranHCID 66995Ethyl orthopropionateHCID 49684717-hydroxy-17-(2-hydroxyacetyl)-10,13,16-trimethyl-7,8,12,14,15,16-hexahydro-6H-cyclopenta[a]phenanthren-3-one

Product 1

HCID 178460418HCID 178460418, compound

Sources & evidence

ORD record
ord-f4ac9ee843e34ab181302e9197fbb647
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (6/10)
DOI
10.1039/C8SC04228D

Reaction notes

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On this pageParticipantsSources & evidenceReaction notes