Sarcovagine B
AlkaPlorer ID: AK039982
Synonym: ''
IUPAC Name: [(2R,3S,4R,5R,8R,9S,10R,13S,14R,17S)-17-[(1S)-1-(dimethylamino)ethyl]-2-hydroxy-10,13-dimethyl-3-[[(E)-2-methylbut-2-enoyl]amino]-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-4-yl] acetate
Structure
SMILES: C/C=C(\C)C(O)=N[C@@H]1[C@H](OC(C)=O)[C@@H]2CC[C@@H]3[C@H]4CC[C@H]([C@H](C)N(C)C)[C@@]4(C)CC[C@@H]3[C@@]2(C)C[C@H]1O
InChI: InChI=1S/C30H50N2O4/c1-9-17(2)28(35)31-26-25(34)16-30(6)23-14-15-29(5)21(18(3)32(7)8)12-13-22(29)20(23)10-11-24(30)27(26)36-19(4)33/h9,18,20-27,34H,10-16H2,1-8H3,(H,31,35)/b17-9+/t18-,20+,21+,22+,23-,24-,25+,26-,27+,29+,30+/m0/s1
InChIKey: QDWARQARJPJBNM-VSHXCSGSSA-N
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Goniothalamus gardneri | Goniothalamus | Annonaceae | Magnoliales | Magnoliopsida | Streptophyta | Viridiplantae | Eukaryota |
Properties Information
Molecule Weight: 502.7400000000004
TPSA？: 82.36000000000001
MolLogP？: 5.399100000000007
Number of H-Donors: 2
Number of H-Acceptors: 5
RingCount: 4
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|