Olean-12-ene-28,29-dioic acid, 3-[(2-O-β-D-galactopyranosyl-β-D-glucopyranuronosyl)oxy]-23-hydroxy-, 28-[O-6-deoxy-α-L-mannopyranosyl-(1→2)-O-[β-D-glucopyranosyl-(1→3)]-6-deoxy-4-O-[(2R)-2-methyl-1-oxobutyl]-β-D-galactopyranosyl] 29-methyl ester, (3β,4α,20β)-

CAS Registry Number®

325489-37-0

CAS Name

Olean-12-ene-28,29-dioic acid, 3-[(2-O-β-D-galactopyranosyl-β-D-glucopyranuronosyl)oxy]-23-hydroxy-, 28-[O-6-deoxy-α-L-mannopyranosyl-(1→2)-O-[β-D-glucopyranosyl-(1→3)]-6-deoxy-4-O-[(2R)-2-methyl-1-oxobutyl]-β-D-galactopyranosyl] 29-methyl ester, (3β,4α,20β)-

Molecular Formula

C66H104O31

Molecular Mass

1393.51

Cite this Page

Olean-12-ene-28,29-dioic acid, 3-[(2-O-β-D-galactopyranosyl-β-D-glucopyranuronosyl)oxy]-23-hydroxy-, 28-[O-6-deoxy-α-L-mannopyranosyl-(1→2)-O-[β-D-glucopyranosyl-(1→3)]-6-deoxy-4-O-[(2R)-2-methyl-1-oxobutyl]-β-D-galactopyranosyl] 29-methyl ester, (3β,4α,20β)-.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=325489-37-0 (retrieved 2024-11-14) (CAS RN: 325489-37-0).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C66H104O31/c1-11-26(2)53(83)92-47-28(4)88-58(51(96-54-44(78)39(73)36(70)27(3)87-54)50(47)95-56-46(80)41(75)38(72)32(24-68)90-56)97-60(85)66-20-18-61(5,59(84)86-10)22-30(66)29-12-13-34-62(6)16-15-35(63(7,25-69)33(62)14-17-65(34,9)64(29,8)19-21-66)91-57-49(43(77)42(76)48(93-57)52(81)82)94-55-45(79)40(74)37(71)31(23-67)89-55/h12,26-28,30-51,54-58,67-80H,11,13-25H2,1-10H3,(H,81,82)/t26-,27+,28-,30+,31-,32-,33-,34-,35+,36+,37+,38-,39-,40+,41+,42+,43+,44-,45-,46-,47+,48+,49-,50+,51-,54+,55+,56+,57-,58+,61+,62+,63+,64-,65-,66+/m1/s1

InChIKey

InChIKey=BMXDKWQTQUHZDL-JPXSFIDHSA-N

SMILES

C(O[C@H]1[C@H](O[C@H]2[C@H](O)[C@H](O)[C@@H](O)[C@H](C)O2)[C@@H](O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)[C@@H](OC([C@@H](CC)C)=O)[C@@H](C)O1)(=O)[C@]45[C@](C=6[C@@](C)(CC4)[C@@]7(C)[C@](CC6)([C@]8(C)[C@@](CC7)([C@@](CO)(C)[C@@H](O[C@H]9[C@H](O[C@@H]%10O[C@H](CO)[C@H](O)[C@H](O)[C@H]%10O)[C@@H](O)[C@H](O)[C@@H](C(O)=O)O9)CC8)[H])[H])(C[C@](C(OC)=O)(C)CC5)[H]

Canonical SMILES

O=C(O)C1OC(OC2CCC3(C)C4CC=C5C6CC(C(=O)OC)(C)CCC6(C(=O)OC7OC(C)C(OC(=O)C(C)CC)C(OC8OC(CO)C(O)C(O)C8O)C7OC9OC(C)C(O)C(O)C9O)CCC5(C)C4(C)CCC3C2(C)CO)C(OC%10OC(CO)C(O)C(O)C%10O)C(O)C1O

Other Names for this Substance

  • Olean-12-ene-28,29-dioic acid, 3-[(2-O-β-D-galactopyranosyl-β-D-glucopyranuronosyl)oxy]-23-hydroxy-, 28-[O-6-deoxy-α-L-mannopyranosyl-(1→2)-O-[β-D-glucopyranosyl-(1→3)]-6-deoxy-4-O-[(2R)-2-methyl-1-oxobutyl]-β-D-galactopyranosyl] 29-methyl ester, (3β,4α,20β)-

CAS INSIGHTSTM
Abstract Background of Blurry Golden Particles