(5aS,5bR,7aR,8R,11aR,11bR,13R,13aS,13bR)-5,5a,5b,6,7,7a,8,9,10,11,11a,11b,12,13,13a,13b-Hexadecahydro-13-hydroxy-8-(hydroxymethyl)-5b,8,11a,13a-tetramethylchryseno[1,2-c]furan-3(1H)-one

CAS Registry Number®

957131-96-3
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CAS Name

(5aS,5bR,7aR,8R,11aR,11bR,13R,13aS,13bR)-5,5a,5b,6,7,7a,8,9,10,11,11a,11b,12,13,13a,13b-Hexadecahydro-13-hydroxy-8-(hydroxymethyl)-5b,8,11a,13a-tetramethylchryseno[1,2-c]furan-3(1H)-one

Molecular Formula

C25H38O4

Molecular Mass

402.57

Cite this Page

(5aS,5bR,7aR,8R,11aR,11bR,13R,13aS,13bR)-5,5a,5b,6,7,7a,8,9,10,11,11a,11b,12,13,13a,13b-Hexadecahydro-13-hydroxy-8-(hydroxymethyl)-5b,8,11a,13a-tetramethylchryseno[1,2-c]furan-3(1H)-one.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=957131-96-3 (retrieved 2024-07-06) (CAS RN: 957131-96-3).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C25H38O4/c1-22(14-26)9-5-10-23(2)17(22)8-11-24(3)18-7-6-15-16(13-29-21(15)28)25(18,4)20(27)12-19(23)24/h6,16-20,26-27H,5,7-14H2,1-4H3/t16-,17-,18-,19+,20+,22-,23-,24-,25+/m0/s1

InChIKey

InChIKey=LXWMXTKOJPFGPW-NFXGRNOLSA-N

SMILES

C[C@]12[C@@]([C@]3(C)[C@@](CC1)([C@@](CO)(C)CCC3)[H])(C[C@@H](O)[C@@]4(C)[C@]2(CC=C5[C@@]4(COC5=O)[H])[H])[H]

Canonical SMILES

O=C1OCC2C1=CCC3C4(C)CCC5C(C)(CO)CCCC5(C)C4CC(O)C23C

Other Names for this Substance

  • Chryseno[1,2-c]furan-3(1H)-one, 5,5a,5b,6,7,7a,8,9,10,11,11a,11b,12,13,13a,13b-hexadecahydro-13-hydroxy-8-(hydroxymethyl)-5b,8,11a,13a-tetramethyl-, (5aS,5bR,7aR,8R,11aR,11bR,13R,13aS,13bR)-
  • (5aS,5bR,7aR,8R,11aR,11bR,13R,13aS,13bR)-5,5a,5b,6,7,7a,8,9,10,11,11a,11b,12,13,13a,13b-Hexadecahydro-13-hydroxy-8-(hydroxymethyl)-5b,8,11a,13a-tetramethylchryseno[1,2-c]furan-3(1H)-one