Sordarin

CAS Registry Number®

11076-17-8
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CAS Name

Sordarin

Molecular Formula

C27H40O8

Molecular Mass

492.60

Cite this Page

Sordarin.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=11076-17-8 (retrieved 2024-08-19) (CAS RN: 11076-17-8).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C27H40O8/c1-13(2)19-8-16-9-25(11-28)18-7-6-14(3)17(18)10-26(16,27(19,25)24(31)32)12-34-23-21(30)20(29)22(33-5)15(4)35-23/h8,11,13-18,20-23,29-30H,6-7,9-10,12H2,1-5H3,(H,31,32)/t14-,15-,16+,17-,18-,20+,21+,22-,23-,25+,26+,27+/m1/s1

InChIKey

InChIKey=OGGVRVMISBQNMQ-YPBSLCSMSA-N

SMILES

C(O)(=O)[C@]12[C@@]3(CO[C@H]4[C@@H](O)[C@H](O)[C@H](OC)[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(OC)C(O)C4O)CC5C(C)CCC52

Other Names for this Substance

  • 1,4-Methano-s-indacene-3a(1H)-carboxylic acid, 8a-[[(6-deoxy-4-O-methyl-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-4-O-methyl-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)]-
  • Sordarin
  • (1R,3aR,4S,4aR,7R,7aR,8aS)-8a-[[(6-Deoxy-4-O-methyl-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