2,9,10,13-tetrakis(acetyloxy)-1-hydroxy-8,12,15,15-tetramethyl-4-methylidenetricyclo[9.3.1.0³,?]pentadec-11-en-5-yl 3-(dimethylamino)-3-phenylpropanoate
AlkaPlorer ID: AK001043
Synonym: None
IUPAC Name: None
Structure
SMILES: C=C1[C@@H](OC(=O)C[C@H](C2=CC=CC=C2)[NH+](C)C)CC[C@@]2(C)[C@@H](OC(C)=O)[C@H](OC(C)=O)C3=C(C)[C@@H](OC(C)=O)C[C@@](O)([C@@H](OC(C)=O)[C@H]12)C3(C)C
InChI: InChI=1S/C39H53NO11/c1-21-29(51-31(45)19-28(40(10)11)27-15-13-12-14-16-27)17-18-38(9)33(21)35(49-25(5)43)39(46)20-30(47-23(3)41)22(2)32(37(39,7)8)34(48-24(4)42)36(38)50-26(6)44/h12-16,28-30,33-36,46H,1,17-20H2,2-11H3/p+1/t28-,29+,30+,33+,34-,35+,36+,38-,39-/m1/s1
InChIKey: WYAAYNQXAYRFAF-WXGAMRAUSA-O
Reference
NPASS: NPC236170
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Taxus baccata | Taxus | Taxaceae | Cupressales | Pinopsida | Streptophyta | Viridiplantae | Eukaryota |
Properties Information
Molecule Weight: 712.8570000000003
TPSA？: 156.17
MolLogP？: 3.3645000000000023
Number of H-Donors: 2
Number of H-Acceptors: 11
RingCount: 4
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|