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English
3beta-Acetoxy,5alpha,11,12,13-tetrahydroxy-eudesm-4(15)-ene
chemical compound
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Statements
instance of
type of chemical entity
0 references
subclass of
[8a-hydroxy-4a-methyl-1-methylidene-7-(1,2,3-trihydroxypropan-2-yl)-3,4,5,6,7,8-hexahydro-2H-naphthalen-2-yl] acetate
1 reference
based on heuristic
inferred from SMILES
mass
328.188588616
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₁₇H₂₈O₆
0 references
canonical SMILES
O=C(OC1C(=C)C2(O)CC(CCC2(C)CC1)C(O)(CO)CO)C
0 references
isomeric SMILES
C=C1[C@@H](OC(C)=O)CC[C@]2(C)CC[C@@H](C(O)(CO)CO)C[C@@]12O
0 references
found in taxon
Achillea holosericea
1 reference
stated in
Two highly oxygenated eudesmanes and 10 lignans from Achillea holosericea
Identifiers
InChI
InChI=1S/C17H28O6/c1-11-14(23-12(2)20)5-7-15(3)6-4-13(8-17(11,15)22)16(21,9-18)10-19/h13-14,18-19,21-22H,1,4-10H2,2-3H3/t13-,14+,15+,17-/m1/s1
0 references
InChIKey
HWCNZSOYAGQUOW-WBTNSWJXSA-N
0 references
PubChem CID
636635
2 references
stated in
PubChem
retrieved
17 September 2022
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
HWCNZSOYAGQUOW-WBTNSWJXSA-N
UniChem compound ID
64695412
1 reference
stated in
UniChem
NMRShiftDB structure ID
2415
1 reference
matched by identifier from
InChIKey
InChIKey
HWCNZSOYAGQUOW-WBTNSWJXSA-N
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