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(Q104915134)
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English
Physalolactone B
group of stereoisomers with the chemical formula C₃₀H₄₄O₆
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Statements
instance of
group of stereoisomers
0 references
subclass of
Withanolides
1 reference
inferred from
Withanolides
mass
500.313789128
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₃₀H₄₄O₆
0 references
canonical SMILES
O=C1OC(CC(=C1C)C)C(O)(C)C2CCC3C4CC=C5CC(O)CC(OC(=O)C)C5(C)C4CCC32C
0 references
found in taxon
Physalis peruviana
1 reference
stated in
New Withanolide Glycosides from Physalis peruviana L.
Identifiers
InChI
InChI=1S/C30H44O6/c1-16-13-26(36-27(33)17(16)2)30(6,34)24-10-9-22-21-8-7-19-14-20(32)15-25(35-18(3)31)29(19,5)23(21)11-12-28(22,24)4/h7,20-26,32,34H,8-15H2,1-6H3
0 references
InChIKey
ANGCIHCSPJLGME-UHFFFAOYSA-N
0 references
PubChem CID
53462649
1 reference
stated in
PubChem
retrieved
26 December 2021
inferred from
InChIKey
ChEBI ID
168104
mapping relation type
exact match
2 references
stated in
ChEBI release 2022-06-13
matched by identifier from
International Chemical Identifier
InChI
InChI=1S/C30H44O6/c1-16-13-26(36-27(33)17(16)2)30(6,34)24-10-9-22-21-8-7-19-14-20(32)15-25(35-18(3)31)29(19,5)23(21)11-12-28(22,24)4/h7,20-26,32,34H,8-15H2,1-6H3
UniChem compound ID
32017287
1 reference
stated in
UniChem
Human Metabolome Database ID
HMDB0034200
2 references
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
ANGCIHCSPJLGME-UHFFFAOYSA-N
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