Chem
J-GLOBAL ID:200907028492825389
Nikkaji number:J782.601J
(23R,24S)-3β-(β-D-Galactopyranosyloxy)-25-methoxy-9β,19-cyclo-16β,23:16,24-diepoxy-5α-lanostan-15α-ol
(23R,24S)-3β-(β-D-ガラクトピラノシルオキシ)-25-メトキシ-9β,19-シクロ-16β,23:16,24-ジエポキシ-5α-ラノスタン-15α-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:
C37 H60 O10
Molecular formula furigana:
C37-H60-O10
Molecular weight:
664.877
InChI:
InChI=1S/C37H60O10/c1-18-15-19-28(32(4,5)43-8)47-37(46-19)27(18)33(6)13-14-36-17-35(36)12-11-23(45-29-26(41)25(40)24(39)20(16-38)44-29)31(2,3)21(35)9-10-22(36)34(33,7)30(37)42/h18-30,38-42H,9-17H2,1-8H3/t18-,19-,20-,21+,22+,23+,24+,25+,26-,27-,28+,29+,30-,33-,34-,35-,36+,37+/m1/s1
InChI key:
PMHQEEVEMWGOAI-HVTOOLEBSA-N
SMILES:
COC(C)(C)[C@H]1O[C@@]23O[C@@H]1C[C@@H](C)[C@@H]2[C@@]1(C)CC[C@@]24C[C@]52CC[C@H](O[C@@H]2O[C@H](CO)[C@H](O)[C@H](O)[C@H]2O)C(C)(C)[C@@H]5CC[C@H]4[C@]1(C)[C@H]3O
Systematic name (3):
(23R,24S)-3β-(β-D-ガラクトピラノシルオキシ)-25-メトキシ-9β,19-シクロ-16β,23:16,24-ジエポキシ-5α-ラノスタン-15α-オール
(2R,3R,4S,5R,6R)-2-{[(1S,2R,3S,4R,7R,9S,12R,14S,17R,18R,19R,21R,22S)-2-ヒドロキシ-22-(2-メトキシプロパン-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,3S,4R,7R,9S,12R,14S,17R,18R,19R,21R,22S)-2-hydroxy-22-(2-methoxypropan-2-yl)-3,8,8,17,19-pentamethyl-23,24-dioxaheptacyclo[19.2.1.01,18 .03,17 .04,14 .07,12 .012,14 ]tetracosan-9-yl]oxy}-6-(hydroxymethyl)oxane-3,4,5-triol
Other name (1):
(23R,24S)-3β-(β-D-Galactopyranosyloxy)-25-methoxy-9β,19-cyclo-16β,23:16,24-diepoxy-5α-lanostan-15α-ol
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