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(Q105114080)
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English
2,3,14-Trihydroxy-10,13-dimethyl-17-(2,3,6-trihydroxy-5,6-dimethylheptan-2-yl)-2,3,4,5,9,11,12,15,16,17-decahydro-1H-cyclopenta[a]phenanthren-6-one
group of stereoisomers with the chemical formula C₂₈H₄₆O₇
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Statements
instance of
group of stereoisomers
0 references
subclass of
ergostane steroid
1 reference
inferred from
ergostane steroid
mass
494.324353812
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₂₈H₄₆O₇
0 references
canonical SMILES
O=C1C=C2C(CCC3(C)C(CCC23O)C(O)(C)C(O)CC(C)C(O)(C)C)C4(C)CC(O)C(O)CC14
0 references
found in taxon
Fibraurea
1 reference
stated in
Cytochrome P3A4 inhibitors and other constituents of Fibraurea tinctoria
Podocarpus macrophyllus
1 reference
stated in
Structure of the further norditerpenoids of Podocarpus macrophyllus. Inumakilactone a glucoside, a plant growth inhibitor and inumakilactone E
Leuzea carthamoides
2 references
stated in
Additional minor ecdysteroid components of Leuzea carthamoides.
stated in
Ecdysteroids from the roots of Leuzea carthamoides
Rhaponticum carthamoides
1 reference
stated in
Additional minor ecdysteroid components of Leuzea carthamoides.
Identifiers
InChI
InChI=1S/C28H46O7/c1-15(24(2,3)33)11-23(32)27(6,34)22-8-10-28(35)17-12-19(29)18-13-20(30)21(31)14-25(18,4)16(17)7-9-26(22,28)5/h12,15-16,18,20-23,30-35H,7-11,13-14H2,1-6H3
0 references
InChIKey
IJRBORPEVKCEQD-UHFFFAOYSA-N
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PubChem CID
12312687
1 reference
stated in
PubChem
retrieved
17 September 2022
based on heuristic
inferred from InChIKey
ChEBI ID
181764
mapping relation type
exact match
1 reference
stated in
ChEBI release 2022-06-13
UniChem compound ID
53630280
1 reference
stated in
UniChem
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