11-Deoxo-6-oxo-5alpha,6-dihydrojervine
AlkaPlorer ID: AK015732
Synonym: 'Tortifolisine', 'Ebeiensine', '(-)-Tortifolisine'
IUPAC Name: None
Structure
SMILES: CC1=C2C[C@H]3[C@@H](CC(=O)[C@H]4C[C@@H](O)CC[C@@]43C)[C@@H]2CC[C@]12O[C@@H]1C[C@H](C)C[NH2+][C@H]1[C@H]2C
InChI: InChI=1S/C27H41NO3/c1-14-9-24-25(28-13-14)16(3)27(31-24)8-6-18-19(15(27)2)11-21-20(18)12-23(30)22-10-17(29)5-7-26(21,22)4/h14,16-18,20-22,24-25,28-29H,5-13H2,1-4H3/p+1/t14-,16+,17-,18+,20-,21-,22+,24+,25-,26+,27-/m0/s1
InChIKey: KYELXPJVGNZIGC-GKFGJCLESA-O
Source
Properties Information
Molecule Weight: 428.6370000000003
TPSA?: 63.14
MolLogP?: 3.2346000000000013
Number of H-Donors: 2
Number of H-Acceptors: 3
RingCount: 6
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
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