Chem
J-GLOBAL ID:200907068284729912
Nikkaji number:J1.266.015D
2α-(3-Hydroxypropyl)-1α,25-dihydroxyvitamin D3
2α-(3-ヒドロキシプロピル)-1α,25-ジヒドロキシビタミンD3
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Substance type:
Substance type
Substance type classified into 3 categories. Decided structure: Substances with a clear structure Undicided Structure: Substances with unknown or undetermined structure Mixtures: Mixtures, racemic compounds, or compounds with relative structural arrangements
Decided structure
Molecular formula:
C30 H50 O4
Molecular formula furigana:
C30-H50-O4
Molecular weight:
474.726
InChI:
InChI=1S/C30H50O4/c1-20(9-6-16-29(3,4)34)25-14-15-26-22(10-7-17-30(25,26)5)12-13-23-19-27(32)24(11-8-18-31)28(33)21(23)2/h12-13,20,24-28,31-34H,2,6-11,14-19H2,1,3-5H3/b22-12+,23-13-/t20-,24+,25-,26+,27-,28-,30-/m1/s1
InChI key:
QOVWEUHJARWCDV-RQSRSJTKSA-N
SMILES:
C[C@H](CCCC(C)(C)O)[C@H]1CC[C@H]2/C(=C/C=C\3/C[C@@H](O)[C@H](CCCO)[C@H](O)C3=C)/CCC[C@]12C
Systematic name (7):
2α-(3-ヒドロキシプロピル)-1α,25-ジヒドロキシコレカルシフェロール
1α,25-ジヒドロキシ-2α-(3-ヒドロキシプロピル)コレカルシフェロール
(5Z,7E)-2α-(3-ヒドロキシプロピル)-9,10-セココレスタ-5,7,10(19)-トリエン-1α,3β,25-トリオール
1α,25-ジヒドロキシ-2α-(3-ヒドロキシプロピル)-22,23-ジヒドロ-28-ノルエルゴカルシフェロール
(14S)-1α,25-ジヒドロキシ-2α-(3-ヒドロキシプロピル)コレカルシフェロール
(1R,2S,3S,5Z)-5-{2-[(1R,3aS,4E,7aR)-1-[(2R)-6-ヒドロキシ-6-メチルヘプタン-2-イル]-7a-メチル-オクタヒドロ-1H-インデン-4-イリデン]エチリデン}-2-(3-ヒドロキシプロピル)-4-メチリデンシクロヘキサン-1,3-ジオール
(1R,2S,3S,5Z)-5-{2-[(1R,3aS,4E,7aR)-1-[(2R)-6-hydroxy-6-methylheptan-2-yl]-7a-methyl-octahydro-1H-inden-4-ylidene]ethylidene}-2-(3-hydroxypropyl)-4-methylidenecyclohexane-1,3-diol
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Other name (8):
2α-(3-Hydroxypropyl)-1α,25-dihydroxycholecalciferol
1α,25-Dihydroxy-2α-(3-hydroxypropyl)cholecalciferol
(5Z,7E)-2α-(3-Hydroxypropyl)-9,10-secocholesta-5,7,10(19)-triene-1α,3β,25-triol
1α,25-Dihydroxy-2α-(3-hydroxypropyl)-22,23-dihydro-28-norergocalciferol
2α-(3-ヒドロキシプロピル)-1α,25-ジヒドロキシビタミンD3
2α-(3-Hydroxypropyl)-1α,25-dihydroxyvitamin D3
(14S)-1α,25-Dihydroxy-2α-(3-hydroxypropyl)cholecalciferol
2α-(3-Hydroxypropyl)-1α,25-dihydroxyvitamin D3
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