Erinacine A

CAS Registry Number®

156101-08-5

CAS Name

Erinacine A

Molecular Formula

C25H36O6

Molecular Mass

432.55

Cite this Page

Erinacine A.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=156101-08-5 (retrieved 2024-11-23) (CAS RN: 156101-08-5).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C25H36O6/c1-14(2)16-7-8-24(3)9-10-25(4)17(20(16)24)6-5-15(12-26)11-19(25)31-23-22(29)21(28)18(27)13-30-23/h5-6,12,14,18-19,21-23,27-29H,7-11,13H2,1-4H3/t18-,19+,21+,22-,23+,24-,25-/m1/s1

InChIKey

InChIKey=LPPCHLAEVDUIIW-NLLUTMDRSA-N

SMILES

C[C@]12C(C=3[C@](C)([C@@H](O[C@H]4[C@H](O)[C@@H](O)[C@H](O)CO4)CC(C=O)=CC3)CC1)=C(C(C)C)CC2

Canonical SMILES

O=CC1=CC=C2C3=C(CCC3(C)CCC2(C)C(OC4OCC(O)C(O)C4O)C1)C(C)C

Other Names for this Substance

  • Cyclohept[e]indene-8-carboxaldehyde, 2,3,3a,4,5,5a,6,7-octahydro-3a,5a-dimethyl-1-(1-methylethyl)-6-(β-D-xylopyranosyloxy)-, (3aR,5aR,6S)-
  • Cyclohept[e]indene-8-carboxaldehyde, 2,3,3a,4,5,5a,6,7-octahydro-3a,5a-dimethyl-1-(1-methylethyl)-6-(β-D-xylopyranosyloxy)-, [3aR-(3aα,5aβ,6α)]-
  • (3aR,5aR,6S)-2,3,3a,4,5,5a,6,7-Octahydro-3a,5a-dimethyl-1-(1-methylethyl)-6-(β-D-xylopyranosyloxy)cyclohept[e]indene-8-carboxaldehyde
  • Erinacin A
  • (+)-Erinacin A

View All

Deleted or Replaced CAS Registry Numbers

210685-65-7

CAS INSIGHTSTM
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