β-D-Glucopyranoside, (3β,5β,6α,25S)-5,6-dihydroxyspirostan-3-yl 4-O-(6-deoxy-α-L-mannopyranosyl)-
CAS Registry Number®
CAS Name
β-D-Glucopyranoside, (3β,5β,6α,25S)-5,6-dihydroxyspirostan-3-yl 4-O-(6-deoxy-α-L-mannopyranosyl)-Molecular Formula
C39H64O14Molecular Mass
756.92Cite this Page
β-D-Glucopyranoside, (3β,5β,6α,25S)-5,6-dihydroxyspirostan-3-yl 4-O-(6-deoxy-α-L-mannopyranosyl)-. CAS Common Chemistry. CAS, a division of the American Chemical Society, n.d. http://commonchemistry.cas.org/detail?cas_rn=265092-98-6 (retrieved ) (CAS RN: 265092-98-6). Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).Other Names and Identifiers
InChI
InChI=1S/C39H64O14/c1-17-6-11-39(48-16-17)18(2)27-24(53-39)13-23-21-12-26(41)38(47)14-20(7-10-37(38,5)22(21)8-9-36(23,27)4)50-35-32(46)30(44)33(25(15-40)51-35)52-34-31(45)29(43)28(42)19(3)49-34/h17-35,40-47H,6-16H2,1-5H3/t17-,18-,19-,20-,21+,22-,23-,24-,25+,26-,27-,28-,29+,30+,31+,32+,33+,34-,35+,36-,37+,38+,39+/m0/s1
InChIKey
InChIKey=GBRQGKIXYHHYOW-NFYXETJKSA-N
SMILES
C[C@@H]1[C@]2(O[C@@]3([C@]1([C@]4(C)[C@@](C3)([C@]5([C@](CC4)([C@]6(C)[C@](O)([C@@H](O)C5)C[C@@H](O[C@@H]7O[C@H](CO)[C@@H](O[C@H]8[C@H](O)[C@H](O)[C@@H](O)[C@H](C)O8)[C@H](O)[C@H]7O)CC6)[H])[H])[H])[H])[H])CC[C@H](C)CO2
Canonical SMILES
OCC1OC(OC2CCC3(C)C4CCC5(C)C(CC6OC7(OCC(C)CC7)C(C)C65)C4CC(O)C3(O)C2)C(O)C(O)C1OC8OC(C)C(O)C(O)C8O
Other Names for this Substance
- β-D-Glucopyranoside, (3β,5β,6α,25S)-5,6-dihydroxyspirostan-3-yl 4-O-(6-deoxy-α-L-mannopyranosyl)-