Geldanamycin; 19-(2-Aminoacetyloxy), 4,5-dihydro
AlkaPlorer ID: AK299105
Synonym: 19-Glycyloxy-4,5-dihydrogeldanamycin, CT-1-2
IUPAC Name: (9-carbamoyloxy-13-hydroxy-8,14,19-trimethoxy-4,10,12,16-tetramethyl-3,20,22-trioxo-2-azabicyclo[16.3.1]docosa-1(21),4,10,18-tetraen-21-yl) 2-aminoacetate
Structure
SMILES: COC1=C2CC(C)CC(OC)C(O)C(C)C=C(C)C(OC(N)=O)C(OC)CCC=C(C)C(=O)NC(=C(OC(=O)CN)C1=O)C2=O
InChI: InChI=1S/C31H45N3O11/c1-15-11-19-25(37)23(29(44-22(35)14-32)26(38)28(19)43-7)34-30(39)16(2)9-8-10-20(41-5)27(45-31(33)40)18(4)13-17(3)24(36)21(12-15)42-6/h9,13,15,17,20-21,24,27,36H,8,10-12,14,32H2,1-7H3,(H2,33,40)(H,34,39)
InChIKey: WGSVWEBIZAGMFX-UHFFFAOYSA-N
Reference
CAS: 1049837-56-0
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Streptomyces hygroscopicus | Streptomyces | Streptomycetaceae | Kitasatosporales | Actinomycetes | Actinomycetota | None | Bacteria |
Properties Information
Molecule Weight: 635.7110000000001
TPSA？: 215.8
MolLogP？: 1.4620000000000042
Number of H-Donors: 4
Number of H-Acceptors: 12
RingCount: 2
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|