TPCN01468

Name 1??,3??,4??-Trihydroxy-8??-acetoxyguai-9,11(13)-dien-6??,12olid
Molecular Formula C17H22O7
Molecular Weight 338.36
CAS Registry Number 796095-59-5
SMILES C=C1C(=O)O[C@H]2[C@H]1[C@@H](OC(C)=O)C=C(C)[C@]1(O)C[C@@H](O)[C@](C)(O)[C@H]21
Classify Sesquiterpenoids
Content
Family Species Part Content (%) Reference DOI
Asteraceae Artemisia suksdorfii Aerial parts 0.000421% J Nat Prod 67, 1705-1710(2004) 10.1021/np049954j
Properties
HBA 7 HBD 3
HeavyAtoms 24 AlogP -0.16
TPSA 113.29 RotatableBonds 1
FractionCSP3 0.65 Rings 3
AromaticRings 0 AliphaticRings 3