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18-acetoxy-3.beta.,15.beta.,16-trihydroxy-ent-ros-5-ene
SpectraBase Compound ID 11hWGcpGmhl
InChI InChI=1S/C22H36O5/c1-14(24)27-13-22(4)17-6-5-15-11-20(2,19(26)12-23)9-10-21(15,3)16(17)7-8-18(22)25/h6,15-16,18-19,23,25-26H,5,7-13H2,1-4H3/t15-,16-,18+,19+,20-,21-,22+/m1/s1
InChIKey WTYBTRGTZZAJCG-MJEICUGTSA-N
Mol Weight 380.5 g/mol
Molecular Formula C22H36O5
Exact Mass 380.256274 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HBq8ZOaRiFf
Name 18-acetoxy-3.beta.,15.beta.,16-trihydroxy-ent-ros-5-ene
Alternate Name(s) (3beta,4beta)-3,15,16-trihydroxyros-5-en-18-yl acetate
CAS Registry Number 119769-60-7
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H36O5
InChI InChI=1S/C22H36O5/c1-14(24)27-13-22(4)17-6-5-15-11-20(2,19(26)12-23)9-10-21(15,3)16(17)7-8-18(22)25/h6,15-16,18-19,23,25-26H,5,7-13H2,1-4H3/t15-,16-,18+,19+,20-,21-,22+/m1/s1
InChIKey WTYBTRGTZZAJCG-MJEICUGTSA-N
Molecular Weight 380.525 g/mol
SMILES O[C@@]1([C@](C2=CC[C@@]3(C[C@]([C@](CO)(O)[H])(CC[C@]3([C@@]2(CC1)[H])C)C)[H])(COC(=O)C)C)[H]
SPLASH splash10-0aw9-0921000000-b8ab4149993931e9ba92
Source of Spectrum J-54-4524-10
Wiley ID 1359836