Olean-12-en-28-oic acid, 3-[(O-6-deoxy-α-L-mannopyranosyl-(1→4)-O-6-deoxy-α-L-mannopyranosyl-(1→3)-O-[β-D-xylopyranosyl-(1→6)]-β-D-glucopyranosyl)oxy]-16-hydroxy-, (3β,16α)-

CAS Registry Number®

139164-70-8

CAS Name

Olean-12-en-28-oic acid, 3-[(O-6-deoxy-α-L-mannopyranosyl-(1→4)-O-6-deoxy-α-L-mannopyranosyl-(1→3)-O-[β-D-xylopyranosyl-(1→6)]-β-D-glucopyranosyl)oxy]-16-hydroxy-, (3β,16α)-

Molecular Formula

C53H86O21

Molecular Mass

1059.24

Cite this Page

Olean-12-en-28-oic acid, 3-[(O-6-deoxy-α-L-mannopyranosyl-(1→4)-O-6-deoxy-α-L-mannopyranosyl-(1→3)-O-[β-D-xylopyranosyl-(1→6)]-β-D-glucopyranosyl)oxy]-16-hydroxy-, (3β,16α)-.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=139164-70-8 (retrieved 2024-11-24) (CAS RN: 139164-70-8).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C53H86O21/c1-22-32(56)35(59)38(62)44(69-22)73-41-23(2)70-45(39(63)36(41)60)74-42-34(58)27(21-68-43-37(61)33(57)26(54)20-67-43)71-46(40(42)64)72-31-13-14-50(7)28(49(31,5)6)12-15-51(8)29(50)11-10-24-25-18-48(3,4)16-17-53(25,47(65)66)30(55)19-52(24,51)9/h10,22-23,25-46,54-64H,11-21H2,1-9H3,(H,65,66)

InChIKey

InChIKey=URWTWFXFHITMQC-UHFFFAOYSA-N

SMILES

C(O)(=O)C12C(C=3C(C)(CC1O)C4(C)C(CC3)C5(C)C(CC4)C(C)(C)C(OC6C(O)C(OC7C(O)C(O)C(OC8C(O)C(O)C(O)C(C)O8)C(C)O7)C(O)C(COC9C(O)C(O)C(O)CO9)O6)CC5)CC(C)(C)CC2

Canonical SMILES

O=C(O)C12CCC(C)(C)CC2C3=CCC4C5(C)CCC(OC6OC(COC7OCC(O)C(O)C7O)C(O)C(OC8OC(C)C(OC9OC(C)C(O)C(O)C9O)C(O)C8O)C6O)C(C)(C)C5CCC4(C)C3(C)CC1O

Other Names for this Substance

  • Olean-12-en-28-oic acid, 3-[(O-6-deoxy-α-L-mannopyranosyl-(1→4)-O-6-deoxy-α-L-mannopyranosyl-(1→3)-O-[β-D-xylopyranosyl-(1→6)]-β-D-glucopyranosyl)oxy]-16-hydroxy-, (3β,16α)-
  • Helianthoside A

CAS INSIGHTSTM
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