2',3',4'-O-methyl-rhamnosyl tetracyclic spinosyn pseudoaglycone
Chemical Formula:
C33H50O9
Molecular Weight:
590.753 Daltons
Monoisotopic Mass:
590.3454832039 Daltons
SMILES:
CCC4(OC(=O)C[CH]3([CH]2(C=C[CH]5(CC(OC1(C(OC)C(OC)C(OC)C(C)O1))C[CH]([CH]2C=C3C(=O)C(C)C(CCC4)O)5))))
InChI:
1S/C33H50O9/c1-7-20-9-8-10-27(34)17(2)29(36)26-15-24-22(25(26)16-28(35)41-20)12-11-19-13-21(14-23(19)24)42-33-32(39-6)31(38-5)30(37-4)18(3)40-33/h11-12,15,17-25,27,30-34H,7-10,13-14,16H2,1-6H3/t17-,18+,19-,20+,21-,22-,23-,24-,25+,27+,30+,31-,32-,33+/m1/s1
InChIKey:
Synonyms
- (2R,3aS,5aR,5bS,9S,13S,14R,16aS,16bR)-9-ethyl-13-hydroxy-14-methyl-2-{[(3R,4R,5S,6S)-3,4,5-trimethoxy-6-methyloxan-2-yl]oxy}-1H,2H,3H,3aH,5aH,5bH,6H,7H,9H,10H,11H,12H,13H,14H,15H,16aH,16bH-as-indaceno[3,2-d]oxacyclododecane-7,15-dione
Databases
MetaCyc:
CPD-14634
PubChem (CID):
11767113
MetaNetX:
MNXM97377