19-Norlanost-5-en-11-one, 20,24-epoxy-3,25-bis(β-D-glucopyranosyloxy)-9-methyl-, (3β,9β,10α,24S)-

CAS Registry Number®

11024-39-8

CAS Name

19-Norlanost-5-en-11-one, 20,24-epoxy-3,25-bis(β-D-glucopyranosyloxy)-9-methyl-, (3β,9β,10α,24S)-

Molecular Formula

C42H68O14

Molecular Mass

796.98

Cite this Page

19-Norlanost-5-en-11-one, 20,24-epoxy-3,25-bis(β-D-glucopyranosyloxy)-9-methyl-, (3β,9β,10α,24S)-.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=53762-90-6 (retrieved 2024-11-26) (CAS RN: 11024-39-8).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C42H68O14/c1-37(2)20-9-11-25-39(5)15-13-24(41(7)16-14-28(55-41)38(3,4)56-36-34(51)32(49)30(47)23(19-44)53-36)40(39,6)17-26(45)42(25,8)21(20)10-12-27(37)54-35-33(50)31(48)29(46)22(18-43)52-35/h9,21-25,27-36,43-44,46-51H,10-19H2,1-8H3/t21-,22-,23-,24+,25+,27+,28+,29-,30-,31+,32+,33-,34-,35+,36+,39+,40-,41+,42+/m1/s1

InChIKey

InChIKey=MEOQGLVBDBQZTF-LPXUVMGASA-N

SMILES

C[C@@]12[C@](C)([C@]3([C@@](C)(C(=O)C1)[C@]4(C(=CC3)C(C)(C)[C@@H](O[C@@H]5O[C@H](CO)[C@@H](O)[C@H](O)[C@H]5O)CC4)[H])[H])CC[C@@]2([C@@]6(C)O[C@H](C(O[C@@H]7O[C@H](CO)[C@@H](O)[C@H](O)[C@H]7O)(C)C)CC6)[H]

Canonical SMILES

O=C1CC2(C)C(CCC2(C)C3CC=C4C(CCC(OC5OC(CO)C(O)C(O)C5O)C4(C)C)C13C)C6(OC(CC6)C(OC7OC(CO)C(O)C(O)C7O)(C)C)C

Other Names for this Substance

  • 19-Norlanost-5-en-11-one, 20,24-epoxy-3,25-bis(β-D-glucopyranosyloxy)-9-methyl-, (3β,9β,10α,24S)-
  • Gratioside
  • Glucoside, gratiogenin, β-D-
  • Gratiolin

Deleted or Replaced CAS Registry Numbers

1399-58-2, 53762-90-6

CAS INSIGHTSTM
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