Aburatubolactam A
AlkaPlorer ID: AK438682
Synonym: None
IUPAC Name: 11-ethyl-2,24-dihydroxy-10,26-dimethyl-21,26-diazatetracyclo[23.2.1.08,15.09,13]octacosa-1,3,5,16,18-pentaene-20,27,28-trione
Structure
SMILES: CCC1CC2CC3C=CC=CC(=O)NCCC(O)C4C(O)=C(C(=O)C=CC=CCC3C2C1C)C(=O)N4C
InChI: InChI=1S/C30H40N2O5/c1-4-19-16-21-17-20-10-8-9-13-25(35)31-15-14-24(34)28-29(36)27(30(37)32(28)3)23(33)12-7-5-6-11-22(20)26(21)18(19)2/h5-10,12-13,18-22,24,26,28,34,36H,4,11,14-17H2,1-3H3,(H,31,35)
InChIKey: KVEUYOLVAMSCBI-UHFFFAOYSA-N
Reference
Patterns of pyrrolizidine alkaloids in 12 Ethiopian Crotalaria species
CAS: 170894-24-3
COCONUT: CNP0425007.1
Source
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Properties Information
Molecule Weight: 508.6590000000003
TPSA？: 106.93999999999998
MolLogP？: 3.6384000000000025
Number of H-Donors: 3
Number of H-Acceptors: 5
RingCount: 4
Activities Information
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