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19-Acetoxy-5(R),15,16-trihydroxyspata-13,17(Z)-diene
SpectraBase Compound ID EgnzqKwd4zj
InChI InChI=1S/C22H34O5/c1-11(10-27-14(4)23)8-17(24)21(26)13(3)15-9-18(25)22(5)16-7-6-12(2)19(16)20(15)22/h8,12,15-21,24-26H,3,6-7,9-10H2,1-2,4-5H3/b11-8-/t12?,15?,16?,17?,18-,19?,20?,21?,22?/m1/s1
InChIKey GHQLAYZQFAJOBW-PQNYGOEJSA-N
Mol Weight 378.5 g/mol
Molecular Formula C22H34O5
Exact Mass 378.240624 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 28fWDYl0UGh
Name 19-Acetoxy-5(R),15,16-trihydroxyspata-13,17(Z)-diene
Alternate Name(s) (2Z)-4,5-dihydroxy-6-[(3R)-3-hydroxy-3a,6-dimethyldecahydrocyclopenta[3,4]cyclobuta[1,2-a]cyclopenten-1-yl]-2-methyl-2,6-heptadienyl acetate
CAS Registry Number 77136-63-1
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H34O5
InChI InChI=1S/C22H34O5/c1-11(10-27-14(4)23)8-17(24)21(26)13(3)15-9-18(25)22(5)16-7-6-12(2)19(16)20(15)22/h8,12,15-21,24-26H,3,6-7,9-10H2,1-2,4-5H3/b11-8-/t12?,15?,16?,17?,18-,19?,20?,21?,22?/m1/s1
InChIKey GHQLAYZQFAJOBW-PQNYGOEJSA-N
Molecular Weight 378.509 g/mol
SMILES OC(C(C(C1C2C(C3C2C(C)CC3)([C@@](C1)(O)[H])C)=C)O)\C=C/(COC(=O)C)C
SPLASH splash10-000i-4900000000-bd723f76642850614a35
Source of Spectrum J-46-2239-0
Wiley ID 1358873