TPCN00821

Name Crocusatin N
Molecular Formula C10H16O4
Molecular Weight 200.23
CAS Registry Number 2304972-15-2
SMILES CC1=C(C(=O)O)C(C)(C)CC(O)C1O
Classify Monoterpenoids
Content
Family Species Part Content (%) Reference DOI
Iridaceae Crocus sativus Flowers 0.000871% Journal of Natural Medicines 76, 102-109 (2022). 10.1007/s11418-021-01559-1
Properties
HBA 4 HBD 3
HeavyAtoms 14 AlogP 0.54
TPSA 77.76 RotatableBonds 1
FractionCSP3 0.70 Rings 1
AromaticRings 0 AliphaticRings 1