TPCN04251

Name Clematichinenoside C
Molecular Formula C70H114O34
Molecular Weight 1499.65
CAS Registry Number 177912-24-2
SMILES CC1OC(OC2C(CO)OC(OCC3OC(OC(=O)C45CCC(C)(C)CC4C4=CCC6C7(C)CCC(OC8OCC(O)C(O)C8OC8OC(C)C(O)C(OC9OCC(OC%10OC(CO)C(O)C(O)C%10O)C(O)C9O)C8O)C(C)(C)C7CCC6(C)C4(C)CC5)C(O)C(O)C3O)C(O)C2O)C(O)C(O)C1O
Classify Triterpenoids
Content
Family Species Part Content (%) Reference DOI
Ranunculaceae Clematis mandshurica Roots 0.008000% J Chromatogr B Analyt Technol Biomed Life Sci. 2007 Jun 1;852(1-2):679-83. 10.1016/j.jchromb.2007.02.056.
Ranunculaceae Clematis chinensis Roots 0.004000% J Asian Nat Prod Res 11(5): 389-396. 10.1080/10286020902867268
Ranunculaceae Clematis uncinata Roots 0.002900% Chem Pharm Bull (Tokyo) 62(1): 35-44. 10.1248/cpb.c13-00269
Ranunculaceae Clematis mandshurica Roots 0.001472% J Asian Nat Prod Res. 2010. 12, 1061-1068. 10.1080/10286020.2010.533661.
Ranunculaceae Clematis mandshurica Roots 0.000960% J Nat Prod. 2006 Nov;69(11):1591-5. 10.1021/np060287z.
Ranunculaceae Clematis terniflora Roots 0.000057% Chem Pharm Bull (Tokyo) . 1998 Dec;46(12):1891-900 10.1248/cpb.46.1891
Properties
HBA 34 HBD 19
HeavyAtoms 104 AlogP -5.23
TPSA 530.66 RotatableBonds 17
FractionCSP3 0.96 Rings 12
AromaticRings 0 AliphaticRings 12