14,18-di-benzoyldelcosine
AlkaPlorer ID: AK010267
Synonym: None
IUPAC Name: None
Structure
SMILES: O[C@@]1(C2C([C@@]34C5[C@@H]([C@]1(C3N(C[C@@]5(CC[C@@H]4O)COC(C6=CC=CC=C6)=O)CC)O)OC)CC7[C@@H]2OC(C8=CC=CC=C8)=O)C[C@@H]7OC
InChI: InChI=1S/C37H45NO9/c1-4-38-19-34(20-46-31(40)21-11-7-5-8-12-21)16-15-26(39)36-24-17-23-25(44-2)18-35(42,37(43,33(36)38)30(45-3)29(34)36)27(24)28(23)47-32(41)22-13-9-6-10-14-22/h5-14,23-30,33,39,42-43H,4,15-20H2,1-3H3/t23?,24?,25-,26-,27?,28-,29?,30-,33?,34-,35+,36+,37+/m0/s1
InChIKey: QYKRUXORMZWABS-VXAJNYIWSA-N
Reference
Cardiotoxicity of Consolida rugulosa, a poisonous weed in Western China
data_source: manually
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
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Properties Information
Molecule Weight: 647.7650000000002
TPSA？: 134.99
MolLogP？: 2.6922000000000006
Number of H-Donors: 3
Number of H-Acceptors: 10
RingCount: 8
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
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