(3R,4S)-8-hydroxy-3,4,5-trimethyl-6-oxo-4,6-dihydro-3H-2-benzopyran-7-carboxylic acid



Compound number:
MolPort-003-665-574
CAS number: 518-75-2
IUPAC:
(3R,4S)-8-hydroxy-3,4,5-trimethyl-6-oxo-4,6-dihydro-3H-2-benzopyran-7-carboxylic acid
IUPAC traditional:
antimycin
SMILES:
C[C@H]1OC=C2C(O)=C(C(O)=O)C(=O)C(C)=C2[C@@H]1C |r,c:14,t:3,6|
InChI key:
CQIUKKVOEOPUDV-IYSWYEEDSA-N
Molecular formula:
C13H14O5
Molecular weight: 250.25
Solubility: not available

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Catalog: Building blocks Ships out: 15 business days Purity: 95%
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More Information

Compound Identifiers
Compound number: MolPort-003-665-574
CAS number: 518-75-2

Names, Synonyms and 3rd Party Identifiers
Name: ZINC000019795941
MFCD00006912
3H-2-Benzopyran-7-carboxylicacid, 4,6-dihydro-8-hydroxy-3,4,5-trimethyl-6-oxo-, (3R,4S)-
(3R,4S)-8-hydroxy-3,4,5-trimethyl-6-oxo-4,6-dihydro-3H-2-benzopyran-7-carboxylic acid
"4,6-Dihydro-8-hydroxy-3,4,5-trimethyl-6-oxo-3H-2-benzopyran-7-carboxylic acid"
4,6-Dihydro-8-hydroxy-3,4,5-trimethyl-6-oxo-3H-2-benzopyran-7-carboxylic acid
(4S,3R)-8-hydroxy-3,4,5-trimethyl-6-oxoisochromane-7-carboxylic acid
Citrinin
Citrinin, Penicillium citrinum

InChI
InChI: 1S/C13H14O5/c1-5-7(3)18-4-8-9(5)6(2)11(14)10(12(8)15)13(16)17/h4-5,7,15H,1-3H3,(H,16,17)/t5-,7-/m1/s1
InChI key: CQIUKKVOEOPUDV-IYSWYEEDSA-N

Calculated Properties
Molecular formula: C13H14O5
Molecular weight: 250.25

Other

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