TPCN02691

[object Object]
Name Pimelotide B
Molecular Formula C32H44O11
Molecular Weight 604.69
CAS Registry Number 1202753-30-7
SMILES C=C(C)C12OC34CCCCCCCC(C)C5C6C7(OC5(C)OC7=O)C(O)C5(CO)OC5C(C1O3)C6(O4)C(C)C2OC(C)=O
Classify Diterpenoids
Content
Family Species Part Content (%) Reference DOI
Thymelaeaceae Pimelea elongata Seeds 0.000380% J Nat Prod 72, 2081-2083 (2009). 10.1021/np900573k
Thymelaeaceae Pimelea elongata Leaves 0.000380% J Nat Prod 73, 1907-1913 (2010). 10.1021/np1005746
Properties
HBA 11 HBD 2
HeavyAtoms 43 AlogP 2.50
TPSA 142.51 RotatableBonds 3
FractionCSP3 0.88 Rings 8
AromaticRings 0 AliphaticRings 8