6'-hydroxy-4-methyl-3'-(4-methyl-5-oxooxolan-2-yl)-octahydrospiro[oxolane-2,9'-pyrrolo[1,2-a]azepin]-5-one
AlkaPlorer ID: AK007383
Synonym: "6'-hydroxy-4-methyl-3'-(4-methyl-5-oxooxolan-2-yl)-octahydrospirooxolane-2,9'-pyrrolo1,2-aazepin-5-one", '6alpha-Hydroxycroomine', '6alpha-hydroxycroomine', '6-Hydroxycroomine'
IUPAC Name: (3S,3'R,6R,9S,9aS)-6-hydroxy-3'-methyl-3-[(2S,4S)-4-methyl-5-oxooxolan-2-yl]spiro[1,2,3,5,6,7,8,9a-octahydropyrrolo[1,2-a]azepine-9,5'-oxolane]-2'-one
Structure
SMILES: C[C@@H]1C[C@]2(CC[C@@H](O)CN3[C@H]2CC[C@H]3[C@@H]2C[C@H](C)C(=O)O2)OC1=O
InChI: InChI=1S/C18H27NO5/c1-10-7-14(23-16(10)21)13-3-4-15-18(8-11(2)17(22)24-18)6-5-12(20)9-19(13)15/h10-15,20H,3-9H2,1-2H3/t10-,11+,12+,13-,14-,15-,18-/m0/s1
InChIKey: XGXUPXRXXQAJRW-ZWLIXYBTSA-N
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Stemona tuberosa | Stemona | Stemonaceae | Pandanales | Magnoliopsida | Streptophyta | Viridiplantae | Eukaryota |
Properties Information
Molecule Weight: 337.4160000000001
TPSA？: 76.07
MolLogP？: 1.2474999999999996
Number of H-Donors: 1
Number of H-Acceptors: 6
RingCount: 4
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|