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(Q104988806)
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English
Orthosiphonol
chemical compound
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Statements
instance of
type of chemical entity
0 references
subclass of
abietane diterpenoid
0 references
mass
346.21440944
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₂₁H₃₀O₄
0 references
canonical SMILES
O=C1C2=C(O)C(=C(O)C(OC)=C2C3(C)CCCC(C)(C)C3C1)C(C)C
0 references
isomeric SMILES
COc1c(O)c(C(C)C)c(O)c2c1[C@@]1(C)CCCC(C)(C)[C@@H]1CC2=O
0 references
found in taxon
Hyptis comaroides
1 reference
stated in
In vitro cytotoxic activity of abietane diterpenes from Peltodon longipes as well as Salvia miltiorrhiza and Salvia sahendica.
Peltodon longipes
1 reference
stated in
In vitro cytotoxic activity of abietane diterpenes from Peltodon longipes as well as Salvia miltiorrhiza and Salvia sahendica.
Identifiers
InChI
InChI=1S/C21H30O4/c1-11(2)14-17(23)15-12(22)10-13-20(3,4)8-7-9-21(13,5)16(15)19(25-6)18(14)24/h11,13,23-24H,7-10H2,1-6H3/t13-,21-/m0/s1
0 references
InChIKey
DTHWSUAQUGVGLC-ZSEKCTLFSA-N
0 references
PubChem CID
12972110
2 references
stated in
PubChem
retrieved
17 September 2022
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
DTHWSUAQUGVGLC-ZSEKCTLFSA-N
UniChem compound ID
1113575
1 reference
stated in
UniChem
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