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(Q105189425)
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Cryptoporic acid A
chemical compound
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Statements
instance of
type of chemical entity
0 references
subclass of
4-[(5,5,8a-trimethyl-2-methylidene-hexahydro-1H-naphthalen-1-yl)methoxy]-5-methoxy-3-(methoxycarbonyl)-5-oxopentanoic acid
1 reference
based on heuristic
inferred from SMILES
mass
424.246103492
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₂₃H₃₆O₇
0 references
canonical SMILES
O=C(O)CC(C(=O)OC)C(OCC1C(=C)CCC2C(C)(C)CCCC12C)C(=O)OC
0 references
isomeric SMILES
C=C1CC[C@H]2C(C)(C)CCC[C@]2(C)[C@H]1CO[C@@H](C(=O)OC)[C@H](CC(=O)O)C(=O)OC
0 references
found in taxon
Cryptoporus volvatus
1 reference
stated in
Cryptoporic acids A-G, drimane-type sesquiterpenoid ethers of isocitric acid from the fungus Cryptoporus volvatus
Identifiers
InChI
InChI=1S/C23H36O7/c1-14-8-9-17-22(2,3)10-7-11-23(17,4)16(14)13-30-19(21(27)29-6)15(12-18(24)25)20(26)28-5/h15-17,19H,1,7-13H2,2-6H3,(H,24,25)/t15-,16-,17-,19+,23+/m0/s1
0 references
InChIKey
OCKYURAITHEIMQ-UGECPWBJSA-N
0 references
PubChem CID
13993281
2 references
stated in
PubChem
retrieved
17 September 2022
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
OCKYURAITHEIMQ-UGECPWBJSA-N
UniChem compound ID
65736680
1 reference
stated in
UniChem
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