A-53930A
AlkaPlorer ID: AK022351
Synonym: None
IUPAC Name: [(2R,3R,4S,5R)-5-[[3-amino-6-[[3-amino-6-[[3-amino-6-(3,6-diaminohexanoylamino)hexanoyl]amino]hexanoyl]amino]hexanoyl]amino]-3,4-dihydroxy-6-[(7-hydroxy-4-oxo-1,3a,5,6,7,7a-hexahydroimidazo[4,5-c]pyridin-2-yl)amino]oxan-2-yl]methyl carbamate
Structure
SMILES: N=C(O)OC[C@H]1OC(NC2=NC3C(O)CN=C(O)C3N2)[C@H](N=C(O)CC(N)CCCN=C(O)CC(N)CCCN=C(O)CC(N)CCCN=C(O)CC(N)CCCN)[C@H](O)[C@H]1O
InChI: InChI=1S/C37H70N14O11/c38-9-1-5-19(39)13-25(53)44-10-2-6-20(40)14-26(54)45-11-3-7-21(41)15-27(55)46-12-4-8-22(42)16-28(56)48-31-33(58)32(57)24(18-61-36(43)60)62-35(31)51-37-49-29-23(52)17-47-34(59)30(29)50-37/h19-24,29-33,35,52,57-58H,1-18,38-42H2,(H2,43,60)(H,44,53)(H,45,54)(H,46,55)(H,47,59)(H,48,56)(H2,49,50,51)/t19?,20?,21?,22?,23?,24-,29?,30?,31-,32+,33+,35?/m1/s1
InChIKey: JFQUFGDPMVGHMW-ISKHFNJQSA-N
Reference
A-53930A and B, Novel N-Type Ca2+ Channel Blockers.
PubChem CID: 139584852
LOTUS: LTS0150359
{NPAtlas: NPA006266
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Streptomyces vinaceusdrappus | Streptomyces | Streptomycetaceae | Kitasatosporales | Actinomycetes | Actinomycetota | None | Bacteria |
Properties Information
Molecule Weight: 887.0539999999994
TPSA？: 452.7000000000001
MolLogP？: -2.296830000000005
Number of H-Donors: 17
Number of H-Acceptors: 19
RingCount: 3
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|