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(Q104401653)
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English
inflexarabdonin I
chemical compound
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Statements
instance of
type of chemical entity
0 references
subclass of
3,11-Dihydroxy-5,5,9-trimethyl-14-methylidenetetracyclo[11.2.1.01,10.04,9]hexadecane-6,15-dione
1 reference
based on heuristic
inferred from SMILES
mass
332.198759376
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₂₀H₂₈O₄
0 references
canonical SMILES
O=C1C(=C)C2CC(O)C3C1(CC(O)C4C(C(=O)CCC43C)(C)C)C2
0 references
isomeric SMILES
C=C1C(=O)[C@]23C[C@H]1C[C@H](O)[C@H]2[C@]1(C)CCC(=O)C(C)(C)[C@H]1[C@@H](O)C3
0 references
found in taxon
Isodon excisus
1 reference
stated in
Kaurane diterpenoids from Isodon excisus inhibit LPS-induced NF-kappaB activation and NO production in macrophage RAW264.7 cells
Isodon inflexus
2 references
stated in
Inflexarabdonins I, J and K, ent-kaurenoids from Rabdosia inflexa
stated in
Longirabdolactone and longirabdacetal, 6,7-seco-ent-kaurenoids from Rabdosia longituba
Identifiers
InChI
InChI=1S/C20H28O4/c1-10-11-7-12(21)16-19(4)6-5-14(23)18(2,3)15(19)13(22)9-20(16,8-11)17(10)24/h11-13,15-16,21-22H,1,5-9H2,2-4H3/t11-,12+,13+,15-,16+,19-,20+/m1/s1
0 references
InChIKey
ONIKMXSBGJJNBQ-ATEWWHSOSA-N
0 references
PubChem CID
44421635
2 references
stated in
PubChem
retrieved
17 September 2022
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
ONIKMXSBGJJNBQ-ATEWWHSOSA-N
UniChem compound ID
451066
1 reference
stated in
UniChem
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