2,6,10,17-Tetraoxatricyclo[11.3.1.11,5]octadecane-7,11-dione, 13-hydroxy-9-(hydroxymethyl)-3-[(1S,4S)-4-(3-hydroxyphenyl)-4-methoxy-1-methylbutyl]-4,14,16,16-tetramethyl-, (1S,3R,4S,5S,9R,13S,14R)-

CAS Registry Number®

66671-95-2

CAS Name

2,6,10,17-Tetraoxatricyclo[11.3.1.11,5]octadecane-7,11-dione, 13-hydroxy-9-(hydroxymethyl)-3-[(1S,4S)-4-(3-hydroxyphenyl)-4-methoxy-1-methylbutyl]-4,14,16,16-tetramethyl-, (1S,3R,4S,5S,9R,13S,14R)-

Molecular Formula

C31H46O10

Molecular Mass

578.69

Cite this Page

2,6,10,17-Tetraoxatricyclo[11.3.1.11,5]octadecane-7,11-dione, 13-hydroxy-9-(hydroxymethyl)-3-[(1S,4S)-4-(3-hydroxyphenyl)-4-methoxy-1-methylbutyl]-4,14,16,16-tetramethyl-, (1S,3R,4S,5S,9R,13S,14R)-.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=66671-95-2 (retrieved 2024-11-12) (CAS RN: 66671-95-2).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C31H46O10/c1-18(10-11-24(37-6)21-8-7-9-22(33)12-21)28-20(3)25-15-31(40-28)29(4,5)14-19(2)30(36,41-31)16-27(35)38-23(17-32)13-26(34)39-25/h7-9,12,18-20,23-25,28,32-33,36H,10-11,13-17H2,1-6H3/t18-,19+,20-,23+,24-,25-,28+,30-,31-/m0/s1

InChIKey

InChIKey=GKTXURNRIDXUNG-QLZZVTGESA-N

SMILES

CC1(C)[C@@]23O[C@](O)([C@H](C)C1)CC(=O)O[C@@H](CO)CC(=O)O[C@@](C2)([C@H](C)[C@@]([C@H](CC[C@H](OC)C4=CC(O)=CC=C4)C)(O3)[H])[H]

Canonical SMILES

O=C1OC2CC3(OC(C(C)CCC(OC)C=4C=CC=C(O)C4)C2C)OC(O)(CC(=O)OC(CO)C1)C(C)CC3(C)C

Other Names for this Substance

  • 2,6,10,17-Tetraoxatricyclo[11.3.1.11,5]octadecane-7,11-dione, 13-hydroxy-9-(hydroxymethyl)-3-[(1S,4S)-4-(3-hydroxyphenyl)-4-methoxy-1-methylbutyl]-4,14,16,16-tetramethyl-, (1S,3R,4S,5S,9R,13S,14R)-
  • Aplysiatoxin, 17-debromo-29-de(1-hydroxyethyl)-29-(hydroxymethyl)-
  • Oscillatoxin A
  • 2,6,10,17-Tetraoxatricyclo[11.3.1.11,5]octadecane-7,11-dione, 13-hydroxy-9-(hydroxymethyl)-3-[4-(3-hydroxyphenyl)-4-methoxy-1-methylbutyl]-4,14,16,16-tetramethyl-, [1S-[1R*,3S*(1R*,4R*),4R*,5R*,9S*,13R*,14S*]]-

CAS INSIGHTSTM
Abstract Background of Blurry Golden Particles