TPCN01776

Name 3-hydroxy-12-hydroxyl coccinic acid
Molecular Formula C30H48O4
Molecular Weight 472.71
CAS Registry Number
SMILES C/C(=CCC[C@@H](C)C1CC[C@]2(C)C3CCC4C(C)(C)[C@H](O)CC[C@]4(C)C3=C[C@H](O)[C@]12C)C(=O)O
Classify Triterpenoids
Content
Family Species Part Content (%) Reference DOI
Schisandraceae Kadsura coccinea Roots 0.001143% Arch Pharm Res. 2010 Dec;33(12):1933-6. 10.1007/s12272-010-1207-0.
Properties
HBA 4 HBD 3
HeavyAtoms 34 AlogP 6.37
TPSA 77.76 RotatableBonds 5
FractionCSP3 0.83 Rings 4
AromaticRings 0 AliphaticRings 4