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(Q104396185)
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English
henryine A
chemical compound
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Statements
instance of
type of chemical entity
0 references
subclass of
2,16-dihydroxy-5-(hydroxymethyl)-5,9-dimethyl-14-methylidenetetracyclo[11.2.1.0¹,¹⁰.0⁴,⁹]hexadecane-11,15-dione
1 reference
based on heuristic
inferred from SMILES
mass
348.193673996
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₂₀H₂₈O₅
0 references
canonical SMILES
O=C1C(=C)C2CC(=O)C3C4(C)CCCC(C)(CO)C4CC(O)C13C2O
0 references
isomeric SMILES
C=C1C(=O)[C@@]23[C@@H](C(=O)C[C@@H]1[C@H]2O)[C@]1(C)CCC[C@](C)(CO)[C@H]1C[C@H]3O
0 references
found in taxon
Isodon flexicaulis
1 reference
stated in
Diterpenoids from Rabdosia flexicaulis
Isodon scoparius
2 references
stated in
Bioactive ent-kaurane diterpenoids from Isodon rubescens.
stated in
ent-Kaurane diterpenoids from Isodon scoparius.
Isodon henryi
2 references
stated in
Chemical structure 7. dBRD9-A.
stated in
4-epi-henryine A, A diterpene from Rabdosia henryi
Isodon phyllostachys
1 reference
stated in
Cytotoxic ent-kaurene diterpenoids from Isodon phyllostachys
Identifiers
InChI
InChI=1S/C20H28O5/c1-10-11-7-12(22)15-19(3)6-4-5-18(2,9-21)13(19)8-14(23)20(15,16(10)24)17(11)25/h11,13-15,17,21,23,25H,1,4-9H2,2-3H3/t11-,13+,14+,15-,17+,18+,19+,20+/m0/s1
0 references
InChIKey
KVVMQRLBODZZRT-AZLPZDFOSA-N
0 references
PubChem CID
16046182
1 reference
stated in
PubChem
retrieved
17 September 2022
based on heuristic
inferred from InChIKey
UniChem compound ID
219703
1 reference
stated in
UniChem
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