For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.

[3aS-(3aR*,8R*,17aR*)]-7,8,17,17a-Tetrahydro-11-hydroxy-13-methoxy-2,2,8-trimethyl-4H-1,3-dioxolo[4,5-h][2]benzoxacyclotetradecin-4,10(3aH)-dione

View entire compound with spectra: 1 MS (GC)

[3aS-(3aR*,8R*,17aR*)]-7,8,17,17a-Tetrahydro-11-hydroxy-13-methoxy-2,2,8-trimethyl-4H-1,3-dioxolo[4,5-h][2]benzoxacyclotetradecin-4,10(3aH)-dione
SpectraBase Compound ID J13DuIQ5Nuv
InChI InChI=1S/C22H26O7/c1-13-7-5-9-16(23)20-18(28-22(2,3)29-20)10-6-8-14-11-15(26-4)12-17(24)19(14)21(25)27-13/h5-6,8-9,11-13,18,20,24H,7,10H2,1-4H3/b8-6-,9-5-/t13-,18-,20+/m0/s1
InChIKey MFUROMODHKJRGA-ZAYVECMYSA-N
Mol Weight 402.44 g/mol
Molecular Formula C22H26O7
Exact Mass 402.167853 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID 9Iy6TtLuGr5
Name [3aS-(3aR*,8R*,17aR*)]-7,8,17,17a-Tetrahydro-11-hydroxy-13-methoxy-2,2,8-trimethyl-4H-1,3-dioxolo[4,5-h][2]benzoxacyclotetradecin-4,10(3aH)-dione
CAS Registry Number 66018-39-1
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H26O7
InChI InChI=1S/C22H26O7/c1-13-7-5-9-16(23)20-18(28-22(2,3)29-20)10-6-8-14-11-15(26-4)12-17(24)19(14)21(25)27-13/h5-6,8-9,11-13,18,20,24H,7,10H2,1-4H3/b8-6-,9-5-/t13-,18-,20+/m0/s1
InChIKey MFUROMODHKJRGA-ZAYVECMYSA-N
Molecular Weight 402.443 g/mol
SMILES Oc1c2C(O[C@](C\C=C/C([C@]3(OC(O[C@]3(C\C=C/c2cc(c1)OC)[H])(C)C)[H])=O)(C)[H])=O
SPLASH splash10-0002-9100000000-6bf582d3fff0e87dea7d
Source of Spectrum J-43-2342-0
Synonyms (3aS,8S,17aS)-11-hydroxy-13-methoxy-2,2,8-trimethyl-7,8,17,17a-tetrahydro-4H-[1,3]dioxolo[4,5-h][2]benzoxacyclotetradecin-4,10(3aH)-dione
Wiley ID 1370353