(1R,3aR,4S,4aR,7R,7aR,8aS)-8a-[[(6-Deoxy-β-D-altropyranosyl)oxy]methyl]-4-formyl-4,4a,5,6,7,7a,8,8a-octahydro-7-methyl-3-(1-methylethyl)-1,4-methano-s-indacene-3a(1H)-carboxylic acid

CAS Registry Number®

178970-49-5

CAS Name

(1R,3aR,4S,4aR,7R,7aR,8aS)-8a-[[(6-Deoxy-β-D-altropyranosyl)oxy]methyl]-4-formyl-4,4a,5,6,7,7a,8,8a-octahydro-7-methyl-3-(1-methylethyl)-1,4-methano-s-indacene-3a(1H)-carboxylic acid

Molecular Formula

C26H38O8

Molecular Mass

478.58

Cite this Page

(1R,3aR,4S,4aR,7R,7aR,8aS)-8a-[[(6-Deoxy-β-D-altropyranosyl)oxy]methyl]-4-formyl-4,4a,5,6,7,7a,8,8a-octahydro-7-methyl-3-(1-methylethyl)-1,4-methano-s-indacene-3a(1H)-carboxylic acid.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=178970-49-5 (retrieved 2024-11-22) (CAS RN: 178970-49-5).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C26H38O8/c1-12(2)18-7-15-8-24(10-27)17-6-5-13(3)16(17)9-25(15,26(18,24)23(31)32)11-33-22-21(30)20(29)19(28)14(4)34-22/h7,10,12-17,19-22,28-30H,5-6,8-9,11H2,1-4H3,(H,31,32)/t13-,14-,15+,16-,17-,19-,20-,21+,22-,24+,25+,26+/m1/s1

InChIKey

InChIKey=YTWDSZAPPKUSFS-OIAXQXJYSA-N

SMILES

C(O)(=O)[C@]12[C@@]3(CO[C@H]4[C@@H](O)[C@H](O)[C@H](O)[C@@H](C)O4)[C@](C[C@]1(C=O)[C@]5([C@](C3)([C@H](C)CC5)[H])[H])(C=C2C(C)C)[H]

Canonical SMILES

O=CC12CC3C=C(C(C)C)C1(C(=O)O)C3(COC4OC(C)C(O)C(O)C4O)CC5C(C)CCC52

Other Names for this Substance

  • 1,4-Methano-s-indacene-3a(1H)-carboxylic acid, 8a-[[(6-deoxy-β-D-altropyranosyl)oxy]methyl]-4-formyl-4,4a,5,6,7,7a,8,8a-octahydro-7-methyl-3-(1-methylethyl)-, (1R,3aR,4S,4aR,7R,7aR,8aS)-
  • 1,4-Methano-s-indacene-3a(1H)-carboxylic acid, 8a-[[(6-deoxy-β-D-altropyranosyl)oxy]methyl]-4-formyl-4,4a,5,6,7,7a,8,8a-octahydro-7-methyl-3-(1-methylethyl)-, [1R-(1α,3aβ,4β,4aβ,7β,7aα,8aβ)]-
  • (1R,3aR,4S,4aR,7R,7aR,8aS)-8a-[[(6-Deoxy-β-D-altropyranosyl)oxy]methyl]-4-formyl-4,4a,5,6,7,7a,8,8a-octahydro-7-methyl-3-(1-methylethyl)-1,4-methano-s-indacene-3a(1H)-carboxylic acid
  • 4′-Demethylsordarin
  • 4′-O-Demethylsordarin

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CAS INSIGHTSTM
Targeted protein degrader structure, illustration