UNPD84819
AlkaPlorer ID: AK229144
Synonym: None
IUPAC Name: [(2S,4aR,4bS,7E,8R,8aS,10aR)-1,1,4a,8-tetramethyl-7-[2-[2-(methylamino)ethoxy]-2-oxoethylidene]-9-oxo-2,3,4,4b,5,6,8,8a,10,10a-decahydrophenanthren-2-yl] 3-hydroxy-3-methylbutanoate
Structure
SMILES: CNCCOC(=O)/C=C1\CC[C@H]2[C@@H](C(=O)C[C@H]3C(C)(C)[C@@H](OC(=O)CC(C)(C)O)CC[C@]23C)[C@H]1C
InChI: InChI=1S/C28H45NO6/c1-17-18(14-23(31)34-13-12-29-7)8-9-19-25(17)20(30)15-21-27(4,5)22(10-11-28(19,21)6)35-24(32)16-26(2,3)33/h14,17,19,21-22,25,29,33H,8-13,15-16H2,1-7H3/b18-14+/t17-,19-,21-,22-,25-,28+/m0/s1
InChIKey: CWEOPNAABDJTEA-LWNGXXMUSA-N
Reference
Coumingidin, ein neues krystallisiertes Alkaloid aus Erythrophleum Couminga
PubChem CID: 162905215
LOTUS: LTS0083538
SuperNatural Ⅲ: SN0057231-02
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Erythrophleum couminga | Erythrophleum | Fabaceae | Fabales | Magnoliopsida | Streptophyta | Viridiplantae | Eukaryota |
Properties Information
Molecule Weight: 491.6690000000003
TPSA？: 101.93
MolLogP？: 3.825800000000002
Number of H-Donors: 2
Number of H-Acceptors: 7
RingCount: 3
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|