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

*Links on SpectraBase are not permalinks.
Briareolate ester G
SpectraBase Compound ID 4FAEBOEvzRn
InChI InChI=1S/C27H40O8/c1-8-9-23(30)35-21-13-11-15(2)10-12-19(16(3)26(32)33-7)25(31)24-17(4)20(29)14-22(27(21,24)6)34-18(5)28/h10,12,16-17,20-22,24,29H,8-9,11,13-14H2,1-7H3/b15-10-,19-12-/t16-,17-,20-,21-,22+,24-,27+/m1/s1
InChIKey PFZIKZPNVHMBFU-QATQSISXSA-N
Mol Weight 492.6 g/mol
Molecular Formula C27H40O8
Exact Mass 492.272318 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 6fF0TAXmKbE
Name Briareolate ester G
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C27H40O8
InChI InChI=1S/C27H40O8/c1-8-9-23(30)35-21-13-11-15(2)10-12-19(16(3)26(32)33-7)25(31)24-17(4)20(29)14-22(27(21,24)6)34-18(5)28/h10,12,16-17,20-22,24,29H,8-9,11,13-14H2,1-7H3/b15-10-,19-12-/t16-,17-,20-,21-,22+,24-,27+/m1/s1
InChIKey PFZIKZPNVHMBFU-QATQSISXSA-N
Molecular Weight 492.609 g/mol
SMILES O[C@@]1(C[C@@]([C@]2([C@@](C(\C(=C/C=C\(CC[C@]2(OC(=O)CCC)[H])C)[C@](C(=O)OC)(C)[H])=O)([C@@]1(C)[H])[H])C)(OC(=O)C)[H])[H]
SPLASH splash10-0zmr-3190500000-0d801352f051cb2b7b5e
Source of Spectrum F-52-9961-7
Synonyms (1S,2R,4S,4aS,5R,12aS)-4-(acetyloxy)-2-hydroxy-11-[(1R)-2-methoxy-1-methyl-2-oxoethyl]-1,4a,8-trimethyl-12-oxo-1,2,3,4,4a,5,6,7,12,12a-decahydrobenzo[a]cyclodecen-5-yl butyrate
Wiley ID 797856