β-D-Glucopyranoside, (3β,6α,12β)-3,12,17-trihydroxy-6-(β-D-xylopyranosyloxy)dammar-24-en-20-yl O-6-deoxy-α-L-mannopyranosyl-(1→6)-O-[β-D-glucopyranosyl-(1→2)]-

CAS Registry Number®

251101-56-1

CAS Name

β-D-Glucopyranoside, (3β,6α,12β)-3,12,17-trihydroxy-6-(β-D-xylopyranosyloxy)dammar-24-en-20-yl O-6-deoxy-α-L-mannopyranosyl-(1→6)-O-[β-D-glucopyranosyl-(1→2)]-

Molecular Formula

C53H90O23

Molecular Mass

1095.27

Cite this Page

β-D-Glucopyranoside, (3β,6α,12β)-3,12,17-trihydroxy-6-(β-D-xylopyranosyloxy)dammar-24-en-20-yl O-6-deoxy-α-L-mannopyranosyl-(1→6)-O-[β-D-glucopyranosyl-(1→2)]-.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=251101-56-1 (retrieved 2024-11-22) (CAS RN: 251101-56-1).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C53H90O23/c1-22(2)11-10-13-52(9,76-47-41(75-46-40(67)36(63)33(60)27(19-54)73-46)37(64)34(61)28(74-47)21-70-44-39(66)35(62)31(58)23(3)71-44)53(68)16-15-50(7)42(53)24(55)17-29-49(6)14-12-30(57)48(4,5)43(49)26(18-51(29,50)8)72-45-38(65)32(59)25(56)20-69-45/h11,23-47,54-68H,10,12-21H2,1-9H3/t23-,24+,25+,26-,27+,28+,29+,30-,31-,32-,33+,34+,35+,36-,37-,38+,39+,40+,41+,42-,43-,44+,45-,46-,47-,49+,50+,51+,52-,53+/m0/s1

InChIKey

InChIKey=OZEDEQJLFBHIEM-RRRCVURHSA-N

SMILES

C[C@]12[C@@]([C@]3(C)[C@@]([C@@H](O[C@H]4[C@H](O)[C@@H](O)[C@H](O)CO4)C1)(C(C)(C)[C@@H](O)CC3)[H])(C[C@@H](O)[C@]5([C@@]2(C)CC[C@@]5([C@@](O[C@H]6[C@H](O[C@@H]7O[C@H](CO)[C@@H](O)[C@H](O)[C@H]7O)[C@@H](O)[C@H](O)[C@@H](CO[C@H]8[C@H](O)[C@H](O)[C@@H](O)[C@H](C)O8)O6)(CCC=C(C)C)C)O)[H])[H]

Canonical SMILES

OCC1OC(OC2C(O)C(O)C(OC2OC(C)(CCC=C(C)C)C3(O)CCC4(C)C3C(O)CC5C6(C)CCC(O)C(C)(C)C6C(OC7OCC(O)C(O)C7O)CC54C)COC8OC(C)C(O)C(O)C8O)C(O)C(O)C1O

Other Names for this Substance

  • β-D-Glucopyranoside, (3β,6α,12β)-3,12,17-trihydroxy-6-(β-D-xylopyranosyloxy)dammar-24-en-20-yl O-6-deoxy-α-L-mannopyranosyl-(1→6)-O-[β-D-glucopyranosyl-(1→2)]-

CAS INSIGHTSTM
Targeted protein degrader structure, illustration