Chem
J-GLOBAL ID:200907023205170685
Nikkaji number:J782.599D
(23R,24S)-3β-(β-D-Galactopyranosyloxy)-9β,19-cyclo-16β,23:16,24-diepoxy-5α-lanost-7-ene-15α,25-diol
(23R,24S)-3β-(β-D-ガラクトピラノシルオキシ)-9β,19-シクロ-16β,23:16,24-ジエポキシ-5α-ラノスタ-7-エン-15α,25-ジオール
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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:
C36 H56 O10
Molecular formula furigana:
C36-H56-O10
Molecular weight:
648.834
InChI:
InChI=1S/C36H56O10/c1-17-14-18-27(31(4,5)42)46-36(45-18)26(17)32(6)12-13-35-16-34(35)11-10-22(44-28-25(40)24(39)23(38)19(15-37)43-28)30(2,3)20(34)8-9-21(35)33(32,7)29(36)41/h9,17-20,22-29,37-42H,8,10-16H2,1-7H3/t17-,18-,19-,20+,22+,23+,24+,25-,26-,27+,28+,29-,32-,33-,34-,35+,36+/m1/s1
InChI key:
JQSWONSGJKJQOF-IYZKNPQJSA-N
SMILES:
C[C@@H]1C[C@H]2O[C@@]3(O[C@@H]2C(C)(C)O)[C@H](O)[C@@]2(C)C4=CC[C@@H]5[C@]6(C[C@@]46CC[C@]2(C)[C@@H]13)CC[C@H](O[C@@H]1O[C@H](CO)[C@H](O)[C@H](O)[C@H]1O)C5(C)C
Systematic name (3):
(23R,24S)-3β-(β-D-ガラクトピラノシルオキシ)-9β,19-シクロ-16β,23:16,24-ジエポキシ-5α-ラノスタ-7-エン-15α,25-ジオール
(2R,3R,4S,5R,6R)-2-{[(1S,2R,3R,7R,9S,12R,14R,17R,18R,19R,21R,22S)-2-ヒドロキシ-22-(2-ヒドロキシプロパン-2-イル)-3,8,8,17,19-ペンタメチル-23,24-ジオキサヘプタシクロ[19.2.1.01,18 .03,17 .04,14 .07,12 .012,14 ]テトラコサ-4-エン-9-イル]オキシ}-6-(ヒドロキシメチル)オキサン-3,4,5-トリオール
(2R,3R,4S,5R,6R)-2-{[(1S,2R,3R,7R,9S,12R,14R,17R,18R,19R,21R,22S)-2-hydroxy-22-(2-hydroxypropan-2-yl)-3,8,8,17,19-pentamethyl-23,24-dioxaheptacyclo[19.2.1.01,18 .03,17 .04,14 .07,12 .012,14 ]tetracos-4-en-9-yl]oxy}-6-(hydroxymethyl)oxane-3,4,5-triol
Other name (1):
(23R,24S)-3β-(β-D-Galactopyranosyloxy)-9β,19-cyclo-16β,23:16,24-diepoxy-5α-lanost-7-ene-15α,25-diol
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