10,13-bis(acetyloxy)-2,9-dihydroxy-8,12,15,15-tetramethyl-4-methylidenetricyclo[9.3.1.0³,?]pentadec-11-en-5-yl 3-(methylamino)-3-phenylpropanoate
AlkaPlorer ID: AK001083
Synonym: None
IUPAC Name: None
Structure
SMILES: C=C1[C@@H](OC(=O)C[C@@H]([NH2+]C)C2=CC=CC=C2)CC[C@@]2(C)[C@@H](O)[C@H](OC(C)=O)C3=C(C)[C@@H](OC(C)=O)C[C@@H]([C@@H](O)[C@H]12)C3(C)C
InChI: InChI=1S/C34H47NO8/c1-18-25(43-27(38)17-24(35-8)22-12-10-9-11-13-22)14-15-34(7)28(18)30(39)23-16-26(41-20(3)36)19(2)29(33(23,5)6)31(32(34)40)42-21(4)37/h9-13,23-26,28,30-32,35,39-40H,1,14-17H2,2-8H3/p+1/t23-,24+,25-,26-,28-,30+,31+,32-,34+/m0/s1
InChIKey: STPQXXGEIVPTJI-VVZHZQEFSA-O
Reference
NPASS: NPC246993
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Taxus canadensis | Taxus | Taxaceae | Cupressales | Pinopsida | Streptophyta | Viridiplantae | Eukaryota |
| Taxus baccata | Taxus | Taxaceae | Cupressales | Pinopsida | Streptophyta | Viridiplantae | Eukaryota |
Properties Information
Molecule Weight: 598.7570000000004
TPSA？: 135.97
MolLogP？: 3.1567000000000007
Number of H-Donors: 3
Number of H-Acceptors: 8
RingCount: 4
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|