Name: Isocalolongic acid
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HIT ID:HIT103416372
Cas No:40737-92-6
Common Name:Isocalolongic acid
IUPAC:3-[(2R,3S)-5-hydroxy-2,3,8,8-tetramethyl-4-oxo-2H,3H,4H,8H-pyrano[2,3-f]chromen-6-yl]hexanoic acid
IUPAC:3-[(2R,3S)-5-hydroxy-2,3,8,8-tetramethyl-4-oxo-2H,3H,4H,8H-pyrano[2,3-f]chromen-6-yl]hexanoic acid
InChIKey:MXFUJXIOAUPXPT-LAGVYOHYSA-N

Molecular Formula:C22H28O6
Molecular Weight:388.46
Hydrogen Bond Donor (HBD):2
Hydrogen Bond Acceptor (HBA):6
LogP:4.777
SMILES:CCCC(CC(O)=O)c1c(O)c2C(=O)[C@@H](C)[C@@H](C)Oc2c2C=CC(C)(C)Oc12 |c:22|
SMILES:CCCC(CC(O)=O)c1c(O)c2C(=O)[C@@H](C)[C@@H](C)Oc2c2C=CC(C)(C)Oc12 |c:22|

Isocalolongic acid is a useful organic compound for research related to life sciences. The catalog number is T124889 and the CAS number is 40737-92-6.

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