Chem
J-GLOBAL ID:200907028282134286
Nikkaji number:J443.626A
Calcitriol lactone
カルシトリオールラクトン
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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:
C27 H40 O5
Molecular formula furigana:
C27-H40-O5
Molecular weight:
444.612
InChI:
InChI=1S/C27H40O5/c1-16(12-21-15-27(4,31)25(30)32-21)22-9-10-23-18(6-5-11-26(22,23)3)7-8-19-13-20(28)14-24(29)17(19)2/h7-8,16,20-24,28-29,31H,2,5-6,9-15H2,1,3-4H3/b18-7+,19-8-/t16-,20-,21+,22-,23+,24+,26-,27-/m1/s1
InChI key:
WMYIVSWWSRCZFA-RWVJFQLJSA-N
SMILES:
C[C@H](C[C@H]1C[C@@](C)(O)C(=O)O1)[C@H]1CC[C@H]2/C(=C/C=C\3/C[C@@H](O)C[C@H](O)C3=C)/CCC[C@]12C
Systematic name (6):
(1S,23S,25R)-1,25-ジヒドロキシ-23,26-エポキシ-26-オキソコレカルシフェロール
(5Z,7E,23S,25R)-1α,3β,23,25-テトラヒドロキシ-9,10-セココレスタ-5,7,10(19)-トリエン-26-酸γ-ラクトン
(5Z,7E,23S,25R)-1α,3β,25-トリヒドロキシ-26-オキソ-9,10-セコ-23,26-エポキシコレスタ-5,7,10(19)-トリエン
(5Z,7E,23S,25R)-1α,3β,23,25-テトラヒドロキシ-9,10-セココレスタ-5,7,10(19)-トリエン-27-酸27,23-ラクトン
(3R,5S)-5-[(2R)-2-[(1R,3aS,4E,7aR)-4-{2-[(1Z,3S,5R)-3,5-ジヒドロキシ-2-メチリデンシクロヘキシリデン]エチリデン}-7a-メチル-オクタヒドロ-1H-インデン-1-イル]プロピル]-3-ヒドロキシ-3-メチルオキソラン-2-オン
(3R,5S)-5-[(2R)-2-[(1R,3aS,4E,7aR)-4-{2-[(1Z,3S,5R)-3,5-dihydroxy-2-methylidenecyclohexylidene]ethylidene}-7a-methyl-octahydro-1H-inden-1-yl]propyl]-3-hydroxy-3-methyloxolan-2-one
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Other name (18):
(1S,23S,25R)-1,25-Dihydroxy-23,26-epoxy-26-oxocholecalciferol
(5Z,7E,23S,25R)-1α,3β,23,25-Tetrahydroxy-9,10-secocholesta-5,7,10(19)-triene-26-oic acid γ-lactone
(23S,25R)-1α,25-ジヒドロキシビタミンD3 26,23-ラクトン
(23S,25R)-1α,25-DihydroxyvitaminD3 26,23-lactone
カルシトリオールラクトン
Calcitriol lactone
23S,25R-1α,25-(OH)2 -D3 -26,23-ラクトン
23S,25R-1α,25-(OH)2 -D3 -26,23-Lactone
(23S,25R)-1α,25-(OH)2 D3 -26,23-ラクトン
(23S,25R)-1α,25-(OH)2 D3 -26,23-Lactone
1α,25(OH)2 D3 -ラクトン
1α,25(OH)2 D3 -Lactone
(23S,25R)-1α,25(OH)2 D3 -26,23-ラクトン
(23S,25R)-1α,25(OH)2 D3 -26,23-lactone
(5Z,7E,23S,25R)-1α,3β,25-Trihydroxy-26-oxo-9,10-seco-23,26-epoxycholesta-5,7,10(19)-triene
(5Z,7E,23S,25R)-1α,3β,23,25-Tetrahydroxy-9,10-secocholesta-5,7,10(19)-triene-27-oic acid 27,23-lactone
(23S,25R)-カルシトリオールラクトン
(23S,25R)-Calcitriol lactone
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CAS registry number:
81203-50-1
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