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(Q105210290)
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English
Physalin I
group of stereoisomers with the chemical formula C₂₉H₃₄O₁₁
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Statements
instance of
group of stereoisomers
0 references
subclass of
chemical compound
0 references
mass
558.5748
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₂₉H₃₄O₁₁
0 references
canonical SMILES
O=C1OC2CC3(C)C1COC45OC6(C3C4=O)C(O)(C(=O)OC26C)CCC7C5CC(O)C8(OC)CC=CC(=O)C78C
0 references
found in taxon
Alkekengi officinarum var. franchetii
3 references
stated in
Isolation, structures, and structure - cytotoxic activity relationships of withanolides and physalins from Physalis angulata
stated in
Physalins E and H, new physalins from Physalis angulata and P. lancifolia
stated in
The rapid discovery and identification of physalins in the calyx of Physalis alkekengi L.var.franchetii (Mast.) Makino using ultra-high performance liquid chromatography-quadrupole time of flight tandem mass spectrometry together with a novel [...]
Identifiers
InChI
InChI=1S/C29H34O11/c1-23-11-18-25(3)29-19(23)20(32)28(40-29,37-12-15(23)21(33)38-18)14-10-17(31)27(36-4)8-5-6-16(30)24(27,2)13(14)7-9-26(29,35)22(34)39-25/h5-6,13-15,17-19,31,35H,7-12H2,1-4H3
0 references
InChIKey
PKBKMEUABLQCJI-UHFFFAOYSA-N
0 references
PubChem CID
131751562
2 references
stated in
PubChem
retrieved
17 September 2022
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
PKBKMEUABLQCJI-UHFFFAOYSA-N
ChEBI ID
173291
mapping relation type
exact match
2 references
stated in
ChEBI release 2022-06-13
matched by identifier from
International Chemical Identifier
InChI
InChI=1S/C29H34O11/c1-23-11-18-25(3)29-19(23)20(32)28(40-29,37-12-15(23)21(33)38-18)14-10-17(31)27(36-4)8-5-6-16(30)24(27,2)13(14)7-9-26(29,35)22(34)39-25/h5-6,13-15,17-19,31,35H,7-12H2,1-4H3
UniChem compound ID
32008780
1 reference
stated in
UniChem
Human Metabolome Database ID
HMDB0034402
2 references
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
PKBKMEUABLQCJI-UHFFFAOYSA-N
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