Cas no 147793-93-9 (Cyclopenta[c]pyran-4-carboxylicacid, 1-(b-D-glucopyranosyloxy)-1,4a,5,6,7,7a-hexahydro-7-hydroxy-7-methyl-,2,6-dimethyl-1,8-octanediyl ester, (1S,1'S,4aS,4'aS,7S,7'S,7aS,7'aS)- (9CI))
![Cyclopenta[c]pyran-4-carboxylicacid, 1-(b-D-glucopyranosyloxy)-1,4a,5,6,7,7a-hexahydro-7-hydroxy-7-methyl-,2,6-dimethyl-1,8-octanediyl ester, (1S,1'S,4aS,4'aS,7S,7'S,7aS,7'aS)- (9CI) structure](https://ossimg.kuujia.com/scimg/148000/147793-93-9x500.png)
147793-93-9 structure
Product Name:Cyclopenta[c]pyran-4-carboxylicacid, 1-(b-D-glucopyranosyloxy)-1,4a,5,6,7,7a-hexahydro-7-hydroxy-7-methyl-,2,6-dimethyl-1,8-octanediyl ester, (1S,1'S,4aS,4'aS,7S,7'S,7aS,7'aS)- (9CI)
CAS No:147793-93-9
MF:C42H66O20
MW:890.961455821991
CID:225744
Update Time:2024-03-03
Cyclopenta[c]pyran-4-carboxylicacid, 1-(b-D-glucopyranosyloxy)-1,4a,5,6,7,7a-hexahydro-7-hydroxy-7-methyl-,2,6-dimethyl-1,8-octanediyl ester, (1S,1'S,4aS,4'aS,7S,7'S,7aS,7'aS)- (9CI) Chemical and Physical Properties
Names and Identifiers
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- Cyclopenta[c]pyran-4-carboxylicacid, 1-(b-D-glucopyranosyloxy)-1,4a,5,6,7,7a-hexahydro-7-hydroxy-7-methyl-,2,6-dimethyl-1,8-octanediyl ester, (1S,1'S,4aS,4'aS,7S,7'S,7aS,7'aS)- (9CI)
- PremnaodorosideA
- Cyclopenta[c]pyran-4-carboxylicacid, 1-(b-D-glucopyranosyloxy)-1,4a,5,6,7,7a-hexahydro-7-hydroxy-7-methyl-,2,6-dimethyl-1,8-o
- (-)-Premnaodoroside A
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- Inchi： 1S/C42H66O20/c1-19(10-13-55-35(51)23-17-57-37(27-21(23)8-11-41(27,3)53)61-39-33(49)31(47)29(45)25(14-43)59-39)6-5-7-20(2)16-56-36(52)24-18-58-38(28-22(24)9-12-42(28,4)54)62-40-34(50)32(48)30(46)26(15-44)60-40/h17-22,25-34,37-40,43-50,53-54H,5-16H2,1-4H3
- InChI Key： DDZSTZLOUPLIAN-UHFFFAOYSA-N
- SMILES： CC(CCOC(C1C2CCC(C2C(OC2C(O)C(O)C(O)C(CO)O2)OC=1)(O)C)=O)CCCC(COC(C1C2CCC(C2C(OC2C(O)C(O)C(O)C(CO)O2)OC=1)(O)C)=O)C
Computed Properties
- Hydrogen Bond Donor Count: 10
- Hydrogen Bond Acceptor Count: 20
- Heavy Atom Count: 62
- XLogP3: 1.01
Cyclopenta[c]pyran-4-carboxylicacid, 1-(b-D-glucopyranosyloxy)-1,4a,5,6,7,7a-hexahydro-7-hydroxy-7-methyl-,2,6-dimethyl-1,8-octanediyl ester, (1S,1'S,4aS,4'aS,7S,7'S,7aS,7'aS)- (9CI) Related Literature
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Helga Garcia,Rui Ferreira,Marija Petkovic,Jamie L. Ferguson,Maria C. Leit?o,H. Q. Nimal Gunaratne,Luís Paulo N. Rebelo Green Chem., 2010,12, 367-369
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Eric Besson,Stéphane Gastaldi,Emily Bloch,Selma Aslan,Hakim Karoui,Olivier Ouari,Micael Hardy Analyst, 2019,144, 4194-4203
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Marcin Czapla,Jack Simons Phys. Chem. Chem. Phys., 2018,20, 21739-21745
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Brindha J.,Balamurali M. M.,Kaushik Chanda RSC Adv., 2019,9, 34720-34734
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Ivor Lon?ari? Phys. Chem. Chem. Phys., 2015,17, 9436-9445
147793-93-9 (Cyclopenta[c]pyran-4-carboxylicacid, 1-(b-D-glucopyranosyloxy)-1,4a,5,6,7,7a-hexahydro-7-hydroxy-7-methyl-,2,6-dimethyl-1,8-octanediyl ester, (1S,1'S,4aS,4'aS,7S,7'S,7aS,7'aS)- (9CI)) Related Products
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