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(15S)-11.beta.,15,16-Triacetoxy-ros-5-ene
SpectraBase Compound ID 47OiaxRLYXe
InChI InChI=1S/C26H40O6/c1-16(27)30-15-23(32-18(3)29)25(6)13-19-10-11-20-21(9-8-12-24(20,4)5)26(19,7)22(14-25)31-17(2)28/h11,19,21-23H,8-10,12-15H2,1-7H3/t19-,21-,22+,23-,25+,26-/m0/s1
InChIKey PNMFXQOZTCMQIW-LUWGGSILSA-N
Mol Weight 448.6 g/mol
Molecular Formula C26H40O6
Exact Mass 448.282489 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KNU91H4Aa2K
Name (15S)-11.beta.,15,16-Triacetoxy-ros-5-ene
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C26H40O6
InChI InChI=1S/C26H40O6/c1-16(27)30-15-23(32-18(3)29)25(6)13-19-10-11-20-21(9-8-12-24(20,4)5)26(19,7)22(14-25)31-17(2)28/h11,19,21-23H,8-10,12-15H2,1-7H3/t19-,21-,22+,23-,25+,26-/m0/s1
InChIKey PNMFXQOZTCMQIW-LUWGGSILSA-N
Molecular Weight 448.600 g/mol
SMILES [C@]12([C@@]3(C(C(C)(C)CCC3)=CC[C@]1(C[C@]([C@@](OC(=O)C)(COC(=O)C)[H])(C)C[C@]2(OC(=O)C)[H])[H])[H])C
SPLASH splash10-0006-9332000000-7b5e301e1eda859facb5
Source of Spectrum Y4-78-218-10
Synonyms (8beta,9alpha,10beta,11alpha,13alpha,15R)-11,15-bis(acetyloxy)ros-5-en-16-yl acetate
Wiley ID 1513028