β-D-Glucopyranosiduronic acid, (3β)-17-carboxy-28-norolean-12-en-3-yl 3-O-α-L-arabinopyranosyl-, 6-methyl ester

CAS Registry Number®

95851-46-0

CAS Name

β-D-Glucopyranosiduronic acid, (3β)-17-carboxy-28-norolean-12-en-3-yl 3-O-α-L-arabinopyranosyl-, 6-methyl ester

Molecular Formula

C42H66O13

Molecular Mass

778.97

Cite this Page

β-D-Glucopyranosiduronic acid, (3β)-17-carboxy-28-norolean-12-en-3-yl 3-O-α-L-arabinopyranosyl-, 6-methyl ester.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=95851-46-0 (retrieved 2024-11-05) (CAS RN: 95851-46-0).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C42H66O13/c1-37(2)15-17-42(36(49)50)18-16-40(6)21(22(42)19-37)9-10-25-39(5)13-12-26(38(3,4)24(39)11-14-41(25,40)7)53-35-30(47)31(29(46)32(55-35)33(48)51-8)54-34-28(45)27(44)23(43)20-52-34/h9,22-32,34-35,43-47H,10-20H2,1-8H3,(H,49,50)

InChIKey

InChIKey=YLACYPLYIMKUHI-UHFFFAOYSA-N

SMILES

CC12C(C3C(C(O)=O)(CC1)CCC(C)(C)C3)=CCC4C2(C)CCC5C4(C)CCC(OC6C(O)C(OC7C(O)C(O)C(O)CO7)C(O)C(C(OC)=O)O6)C5(C)C

Canonical SMILES

O=C(O)C12CCC(C)(C)CC2C3=CCC4C5(C)CCC(OC6OC(C(=O)OC)C(O)C(OC7OCC(O)C(O)C7O)C6O)C(C)(C)C5CCC4(C)C3(C)CC1

Other Names for this Substance

  • β-D-Glucopyranosiduronic acid, (3β)-17-carboxy-28-norolean-12-en-3-yl 3-O-α-L-arabinopyranosyl-, 6-methyl ester
  • 28-Noroleanane, β-D-glucopyranosiduronic acid deriv.
  • Momordin Ia

CAS INSIGHTSTM
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