validamycin B
Chemical Formula:
C20H36NO14
Molecular Weight:
514.503 Daltons
Monoisotopic Mass:
514.2135798702 Daltons
SMILES:
C(C1(C(C(C(C(C=1)[N+]C2(C(C(C(C(C(O)2)CO)OC3(OC(C(C(C3O)O)O)CO))O)O))O)O)O))O
InChI:
1S/C20H35NO14/c22-2-5-1-7(12(27)15(30)10(5)25)21-9-11(26)6(3-23)19(17(32)14(9)29)35-20-18(33)16(31)13(28)8(4-24)34-20/h1,6-33H,2-4H2/p+1/t6-,7-,8+,9-,10+,11+,12-,13+,14-,15-,16-,17+,18+,19+,20-/m0/s1
InChIKey:
Synonyms
- (1R,2R,3S,4S,5R,6S)-2,3,5-trihydroxy-6-(hydroxymethyl)-4-{[(1S,4R,5S,6S)-4,5,6-trihydroxy-3-(hydroxymethyl)cyclohex-2-en-1-yl]amino}cyclohexyl β-D-glucopyranoside
Databases
MetaCyc:
CPD-18790
PubChem (CID):
122706280
HMDB:
HMDB36593
ChEBI:
90868
MetaNetX:
MNXM145223
KEGG:
C21293