Chem
J-GLOBAL ID:200907078661328745
Nikkaji number:J678.297C
6α-Hydroxycampestanol
6α-ヒドロキシカンペスタノール
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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:
C28 H50 O2
Molecular formula furigana:
C28-H50-O2
Molecular weight:
418.706
InChI:
InChI=1S/C28H50O2/c1-17(2)18(3)7-8-19(4)22-9-10-23-21-16-26(30)25-15-20(29)11-13-28(25,6)24(21)12-14-27(22,23)5/h17-26,29-30H,7-16H2,1-6H3/t18-,19-,20+,21+,22-,23+,24+,25-,26+,27-,28-/m1/s1
InChI key:
XOCKKQKIUYNBRG-XYCVKZCMSA-N
SMILES:
CC(C)[C@H](C)CC[C@@H](C)[C@H]1CC[C@H]2[C@@H]3C[C@H](O)[C@H]4C[C@@H](O)CC[C@]4(C)[C@H]3CC[C@]12C
Systematic name (3):
(24R)-5α-エルゴスタン-3β,6α-ジオール
(1R,3aS,3bS,5S,5aS,7S,9aR,9bS,11aR)-1-[(2R,5R)-5,6-ジメチルヘプタン-2-イル]-9a,11a-ジメチル-ヘキサデカヒドロ-1H-シクロペンタ[a]フェナントレン-5,7-ジオール
(1R,3aS,3bS,5S,5aS,7S,9aR,9bS,11aR)-1-[(2R,5R)-5,6-dimethylheptan-2-yl]-9a,11a-dimethyl-hexadecahydro-1H-cyclopenta[a]phenanthrene-5,7-diol
Other name (3):
6α-ヒドロキシカンペスタノール
6α-Hydroxycampestanol
(24R)-5α-Ergostane-3β,6α-diol
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