Glycinoeclepin A

CAS Registry Number®

83216-10-8

CAS Name

Glycinoeclepin A

Molecular Formula

C25H34O7

Molecular Mass

446.53

Cite this Page

Glycinoeclepin A.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=83216-10-8 (retrieved 2024-11-23) (CAS RN: 83216-10-8).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    120-123 °C

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C25H34O7/c1-13(10-18(27)28)23(4)8-6-15-19(20(29)30)14(11-16(26)24(15,23)5)12-25-9-7-17(32-25)22(2,3)21(25)31/h6,13,16-17,26H,7-12H2,1-5H3,(H,27,28)(H,29,30)/t13-,16-,17+,23+,24+,25+/m1/s1

InChIKey

InChIKey=XOLYVYHBERHQBZ-FMNVCWJRSA-N

SMILES

C([C@]12O[C@](C(C)(C)C1=O)(CC2)[H])C3=C(C(O)=O)C=4[C@@](C)([C@H](O)C3)[C@@]([C@@H](CC(O)=O)C)(C)CC4

Canonical SMILES

O=C(O)C=1C2=CCC(C)(C(C)CC(=O)O)C2(C)C(O)CC1CC34OC(CC3)C(C4=O)(C)C

Other Names for this Substance

  • 1H-Indene-1-propanoic acid, 4-carboxy-5-[[(1S,4S)-3,3-dimethyl-2-oxo-7-oxabicyclo[2.2.1]hept-1-yl]methyl]-2,6,7,7a-tetrahydro-7-hydroxy-β,1,7a-trimethyl-, (βR,1S,7R,7aS)-
  • 1H-Indene-1-propanoic acid, 4-carboxy-5-[(3,3-dimethyl-2-oxo-7-oxabicyclo[2.2.1]hept-1-yl)methyl]-2,6,7,7a-tetrahydro-7-hydroxy-β,1,7a-trimethyl-, [1S-[1α(S*),5(1R*,4R*),7β,7aα]]-
  • 7-Oxabicyclo[2.2.1]heptane, 1H-indene-1-propanoic acid deriv.
  • (βR,1S,7R,7aS)-4-Carboxy-5-[[(1S,4S)-3,3-dimethyl-2-oxo-7-oxabicyclo[2.2.1]hept-1-yl]methyl]-2,6,7,7a-tetrahydro-7-hydroxy-β,1,7a-trimethyl-1H-indene-1-propanoic acid
  • Glycinoeclepin A

CAS INSIGHTSTM
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