β-D-Glucopyranoside, (3β,5α,25R)-spirostan-3-yl O-β-D-galactopyranosyl-(1→4)-O-β-D-glucopyranosyl-(1→2)-O-[O-β-D-glucopyranosyl-(1→4)-6-deoxy-α-L-mannopyranosyl-(1→3)]-
CAS Registry Number®
95522-98-8
CAS Name
β-D-Glucopyranoside, (3β,5α,25R)-spirostan-3-yl O-β-D-galactopyranosyl-(1→4)-O-β-D-glucopyranosyl-(1→2)-O-[O-β-D-glucopyranosyl-(1→4)-6-deoxy-α-L-mannopyranosyl-(1→3)]-Molecular Formula
C57H94O27Molecular Mass
1211.34Cite this Page
β-D-Glucopyranoside, (3β,5α,25R)-spirostan-3-yl O-β-D-galactopyranosyl-(1→4)-O-β-D-glucopyranosyl-(1→2)-O-[O-β-D-glucopyranosyl-(1→4)-6-deoxy-α-L-mannopyranosyl-(1→3)]-. CAS Common Chemistry. CAS, a division of the American Chemical Society, n.d. http://commonchemistry.cas.org/detail?cas_rn=95522-98-8 (retrieved ) (CAS RN: 95522-98-8). Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).Other Names and Identifiers
InChI
InChI=1S/C57H94O27/c1-21-8-13-57(73-20-21)22(2)34-29(84-57)15-28-26-7-6-24-14-25(9-11-55(24,4)27(26)10-12-56(28,34)5)75-54-49(83-53-45(72)41(68)47(33(19-61)79-53)81-52-43(70)39(66)36(63)31(17-59)77-52)48(37(64)32(18-60)78-54)82-50-44(71)40(67)46(23(3)74-50)80-51-42(69)38(65)35(62)30(16-58)76-51/h21-54,58-72H,6-20H2,1-5H3
InChIKey
InChIKey=QUIDADXDQQWNCN-UHFFFAOYSA-N
SMILES
CC12C3C(CC1C4C(CC2)C5(C)C(CC4)CC(OC6C(OC7OC(CO)C(OC8OC(CO)C(O)C(O)C8O)C(O)C7O)C(OC9C(O)C(O)C(OC%10OC(CO)C(O)C(O)C%10O)C(C)O9)C(O)C(CO)O6)CC5)OC%11(C3C)CCC(C)CO%11
Canonical SMILES
OCC1OC(OC2C(O)C(O)C(OC2C)OC3C(O)C(OC(OC4CCC5(C)C(CCC6C5CCC7(C)C6CC8OC9(OCC(C)CC9)C(C)C87)C4)C3OC%10OC(CO)C(OC%11OC(CO)C(O)C(O)C%11O)C(O)C%10O)CO)C(O)C(O)C1O
Other Names for this Substance
- β-D-Glucopyranoside, (3β,5α,25R)-spirostan-3-yl O-β-D-galactopyranosyl-(1→4)-O-β-D-glucopyranosyl-(1→2)-O-[O-β-D-glucopyranosyl-(1→4)-6-deoxy-α-L-mannopyranosyl-(1→3)]-
- Spiro[8H-naphth[2′,1′:4,5]indeno[2,1-b]furan-8,2′-[2H]pyran], β-D-glucopyranoside deriv.
- Spirostan, β-D-glucopyranoside deriv.
- (-)-Melongoside L
- Melongoside L
