TPCN05984

Name 12-oxo-2??,3??,20(S)-trihydroxydammar-24-ene-3-O-[??-D-glucopyranosyl(1??2)-??-D-glucopyranosyl]-20-O-[??-D-xylopyranosyl(1??6)-??-D-glucopyranoside]
Molecular Formula C53H88O23
Molecular Weight 1093.26
CAS Registry Number 184022-12-6
SMILES CC(C)=CCCC(C)(OC1OC(COC2OCC(O)C(O)C2O)C(O)C(O)C1O)C1CCC2(C)C1C(=O)CC1C3(C)CC(O)C(OC4OC(CO)C(O)C(O)C4OC4OC(CO)C(O)C(O)C4O)C(C)(C)C3CCC12C
Classify Triterpenoids
Content
Family Species Part Content (%) Reference DOI
Cucurbitaceae Gynostemma pentaphyllum Aerial parts 0.004000% J Nat Prod . 1996 Dec;59(12):1143-5 10.1021/np960445u
Properties
HBA 23 HBD 14
HeavyAtoms 76 AlogP -2.38
TPSA 374.13 RotatableBonds 15
FractionCSP3 0.94 Rings 8
AromaticRings 0 AliphaticRings 8