UNPD44901
AlkaPlorer ID: AK168265
Synonym: None
IUPAC Name: methyl (1S,4aR,4bS,7E,8R,8aR,9S,10aR)-9-hydroxy-7-[2-[2-hydroxyethyl(methyl)amino]-2-oxoethylidene]-1,4a,8-trimethyl-3,4,4b,5,6,8,8a,9,10,10a-decahydro-2H-phenanthrene-1-carboxylate
Structure
SMILES: COC(=O)[C@@]1(C)CCC[C@@]2(C)[C@H]1C[C@H](O)[C@@H]1[C@@H](C)/C(=C/C(=O)N(C)CCO)CC[C@@H]12
InChI: InChI=1S/C24H39NO5/c1-15-16(13-20(28)25(4)11-12-26)7-8-17-21(15)18(27)14-19-23(17,2)9-6-10-24(19,3)22(29)30-5/h13,15,17-19,21,26-27H,6-12,14H2,1-5H3/b16-13+/t15-,17-,18-,19+,21+,23+,24-/m0/s1
InChIKey: WWNAKNLFTIEHKX-SMRDVDKPSA-N
Reference
Tumour inhibitory plants. New alkaloids from the bark of Erythrophleum chlorostachys (Leguminosae)
PubChem CID: 162921086
LOTUS: LTS0099255
SuperNatural Ⅲ: SN0421878-04
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Erythrophleum chlorostachys | Erythrophleum | Fabaceae | Fabales | Magnoliopsida | Streptophyta | Viridiplantae | Eukaryota |
Properties Information
Molecule Weight: 421.57800000000026
TPSA？: 87.07000000000001
MolLogP？: 2.7761000000000005
Number of H-Donors: 2
Number of H-Acceptors: 5
RingCount: 3
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|