(3β,25R)-26-(β-D-Glucopyranosyloxy)-22-hydroxyfurost-4-en-3-yl 2-O-(6-deoxy-α-L-mannopyranosyl)-β-D-glucopyranoside
CAS Registry Number®
CAS Name
(3β,25R)-26-(β-D-Glucopyranosyloxy)-22-hydroxyfurost-4-en-3-yl 2-O-(6-deoxy-α-L-mannopyranosyl)-β-D-glucopyranosideMolecular Formula
C45H74O18Molecular Mass
903.06Cite this Page
(3β,25R)-26-(β-D-Glucopyranosyloxy)-22-hydroxyfurost-4-en-3-yl 2-O-(6-deoxy-α-L-mannopyranosyl)-β-D-glucopyranoside. CAS Common Chemistry. CAS, a division of the American Chemical Society, n.d. http://commonchemistry.cas.org/detail?cas_rn=290348-00-4 (retrieved ) (CAS RN: 290348-00-4). Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).Other Names and Identifiers
InChI
InChI=1S/C45H74O18/c1-19(18-57-40-37(54)35(52)32(49)28(16-46)60-40)8-13-45(56)20(2)30-27(63-45)15-26-24-7-6-22-14-23(9-11-43(22,4)25(24)10-12-44(26,30)5)59-42-39(36(53)33(50)29(17-47)61-42)62-41-38(55)34(51)31(48)21(3)58-41/h14,19-21,23-42,46-56H,6-13,15-18H2,1-5H3/t19-,20+,21+,23+,24-,25+,26+,27+,28-,29-,30+,31+,32-,33-,34-,35+,36+,37-,38-,39-,40-,41+,42-,43+,44+,45-/m1/s1
InChIKey
InChIKey=LWXZBNGSFONONO-JPHOUZCVSA-N
SMILES
C[C@@]12[C@]([C@]3([C@](CC1)([C@]4(C)C(CC3)=C[C@@H](O[C@H]5[C@H](O[C@H]6[C@H](O)[C@H](O)[C@@H](O)[C@H](C)O6)[C@@H](O)[C@H](O)[C@@H](CO)O5)CC4)[H])[H])(C[C@]7([C@@]2([C@H](C)[C@](CC[C@H](CO[C@@H]8O[C@H](CO)[C@@H](O)[C@H](O)[C@H]8O)C)(O)O7)[H])[H])[H]
Canonical SMILES
OCC1OC(OCC(C)CCC2(O)OC3CC4C5CCC6=CC(OC7OC(CO)C(O)C(O)C7OC8OC(C)C(O)C(O)C8O)CCC6(C)C5CCC4(C)C3C2C)C(O)C(O)C1O
Other Names for this Substance
- β-D-Glucopyranoside, (3β,25R)-26-(β-D-glucopyranosyloxy)-22-hydroxyfurost-4-en-3-yl 2-O-(6-deoxy-α-L-mannopyranosyl)-
- (3β,25R)-26-(β-D-Glucopyranosyloxy)-22-hydroxyfurost-4-en-3-yl 2-O-(6-deoxy-α-L-mannopyranosyl)-β-D-glucopyranoside
- Trigoneoside XIIb