Olean-12-en-28-oic acid, 3-[(2-O-β-D-glucopyranosyl-β-D-glucopyranosyl)oxy]-, O-α-L-arabinopyranosyl-(1→3)-O-β-D-xylopyranosyl-(1→4)-O-[β-D-xylopyranosyl-(1→3)]-O-6-deoxy-α-L-mannopyranosyl-(1→2)-α-L-arabinopyranosyl ester, (3β)-

CAS Registry Number®

135545-79-8
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CAS Name

Olean-12-en-28-oic acid, 3-[(2-O-β-D-glucopyranosyl-β-D-glucopyranosyl)oxy]-, O-α-L-arabinopyranosyl-(1→3)-O-β-D-xylopyranosyl-(1→4)-O-[β-D-xylopyranosyl-(1→3)]-O-6-deoxy-α-L-mannopyranosyl-(1→2)-α-L-arabinopyranosyl ester, (3β)-

Molecular Formula

C68H110O33

Molecular Mass

1455.58

Cite this Page

Olean-12-en-28-oic acid, 3-[(2-O-β-D-glucopyranosyl-β-D-glucopyranosyl)oxy]-, O-α-L-arabinopyranosyl-(1→3)-O-β-D-xylopyranosyl-(1→4)-O-[β-D-xylopyranosyl-(1→3)]-O-6-deoxy-α-L-mannopyranosyl-(1→2)-α-L-arabinopyranosyl ester, (3β)-.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=135545-79-8 (retrieved 2024-09-20) (CAS RN: 135545-79-8).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C68H110O33/c1-26-50(96-57-48(85)51(32(74)25-90-57)97-55-45(82)38(75)29(71)22-88-55)52(98-56-46(83)39(76)30(72)23-89-56)49(86)59(92-26)99-53-40(77)31(73)24-91-60(53)101-62(87)68-17-15-63(2,3)19-28(68)27-9-10-36-65(6)13-12-37(64(4,5)35(65)11-14-67(36,8)66(27,7)16-18-68)95-61-54(44(81)42(79)34(21-70)94-61)100-58-47(84)43(80)41(78)33(20-69)93-58/h9,26,28-61,69-86H,10-25H2,1-8H3

InChIKey

InChIKey=QWABEDSRNSIDQD-UHFFFAOYSA-N

SMILES

C(OC1C(OC2C(O)C(OC3C(O)C(O)C(O)CO3)C(OC4C(O)C(OC5C(O)C(O)C(O)CO5)C(O)CO4)C(C)O2)C(O)C(O)CO1)(=O)C67C(C=8C(C)(CC6)C9(C)C(CC8)C%10(C)C(CC9)C(C)(C)C(OC%11C(OC%12OC(CO)C(O)C(O)C%12O)C(O)C(O)C(CO)O%11)CC%10)CC(C)(C)CC7

Canonical SMILES

O=C(OC1OCC(O)C(O)C1OC2OC(C)C(OC3OCC(O)C(OC4OCC(O)C(O)C4O)C3O)C(OC5OCC(O)C(O)C5O)C2O)C67CCC(C)(C)CC7C8=CCC9C%10(C)CCC(OC%11OC(CO)C(O)C(O)C%11OC%12OC(CO)C(O)C(O)C%12O)C(C)(C)C%10CCC9(C)C8(C)CC6

Other Names for this Substance

  • Olean-12-en-28-oic acid, 3-[(2-O-β-D-glucopyranosyl-β-D-glucopyranosyl)oxy]-, O-α-L-arabinopyranosyl-(1→3)-O-β-D-xylopyranosyl-(1→4)-O-[β-D-xylopyranosyl-(1→3)]-O-6-deoxy-α-L-mannopyranosyl-(1→2)-α-L-arabinopyranosyl ester, (3β)-
  • Acutoside G