3-[2-[(1R,4aS,5R,8aS)-Decahydro-5-(hydroxymethyl)-5,8a-dimethyl-2-methylene-1-naphthalenyl]ethyl]-2(5H)-furanone

CAS Registry Number®

82209-74-3
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CAS Name

3-[2-[(1R,4aS,5R,8aS)-Decahydro-5-(hydroxymethyl)-5,8a-dimethyl-2-methylene-1-naphthalenyl]ethyl]-2(5H)-furanone

Molecular Formula

C20H30O3

Molecular Mass

318.45

Cite this Page

3-[2-[(1R,4aS,5R,8aS)-Decahydro-5-(hydroxymethyl)-5,8a-dimethyl-2-methylene-1-naphthalenyl]ethyl]-2(5H)-furanone.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=82209-74-3 (retrieved 2024-07-06) (CAS RN: 82209-74-3).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    106-107 °C

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C20H30O3/c1-14-5-8-17-19(2,13-21)10-4-11-20(17,3)16(14)7-6-15-9-12-23-18(15)22/h9,16-17,21H,1,4-8,10-13H2,2-3H3/t16-,17-,19+,20+/m1/s1

InChIKey

InChIKey=WKKBRRFSRMDTJB-JYBIWHBTSA-N

SMILES

C[C@]12[C@@]([C@@](CO)(C)CCC1)(CCC(=C)[C@H]2CCC=3C(=O)OCC3)[H]

Canonical SMILES

O=C1OCC=C1CCC2C(=C)CCC3C(C)(CO)CCCC23C

Other Names for this Substance

  • 2(5H)-Furanone, 3-[2-[(1R,4aS,5R,8aS)-decahydro-5-(hydroxymethyl)-5,8a-dimethyl-2-methylene-1-naphthalenyl]ethyl]-
  • 2(5H)-Furanone, 3-[2-[decahydro-5-(hydroxymethyl)-5,8a-dimethyl-2-methylene-1-naphthalenyl]ethyl]-, [1R-(1α,4aβ,5α,8aα)]-
  • 3-[2-[(1R,4aS,5R,8aS)-Decahydro-5-(hydroxymethyl)-5,8a-dimethyl-2-methylene-1-naphthalenyl]ethyl]-2(5H)-furanone
  • Andrograpanin
  • 3,14-Dideoxyandrographolide