Isoacteoside

• CAS: 61303-13-7
• Catalog Number: ACM61303137
• Category: Other Products
• Molecular Weight: 624.59
• Molecular Formula: C29H36O15
• Synonyms: Isoverbascoside

Custom Q&A

What is the molecular formula of Isoacteoside?

The molecular formula of Isoacteoside is C29H36O15.

What is the molecular weight of Isoacteoside?

The molecular weight of Isoacteoside is 624.6 g/mol.

What is the IUPAC name of Isoacteoside?

The IUPAC name of Isoacteoside is [(2R,3R,4S,5R,6R)-6-[2-(3,4-dihydroxyphenyl)ethoxy]-3,5-dihydroxy-4-[(2S,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxyoxan-2-yl]methyl (E)-3-(3,4-dihydroxyphenyl)prop-2-enoate.

What is the InChI of Isoacteoside?

The InChI of Isoacteoside is InChI=1S/C29H36O15/c1-13-22(35)24(37)25(38)29(42-13)44-27-23(36)20(12-41-21(34)7-4-14-2-5-16(30)18(32)10-14)43-28(26(27)39)40-9-8-15-3-6-17(31)19(33)11-15/h2-7,10-11,13,20,22-33,35-39H,8-9,12H2,1H3/b7-4+/t13-,20+,22-,23+,24+,25+,26+,27-,28+,29-/m0/s1.

What is the InChIKey of Isoacteoside?

The InChIKey of Isoacteoside is FNMHEHXNBNCPCI-QEOJJFGVSA-N.

What is the canonical SMILES of Isoacteoside?

The canonical SMILES of Isoacteoside is CC1C(C(C(C(O1)OC2C(C(OC(C2O)OCCC3=CC(=C(C=C3)O)O)COC(=O)C=CC4=CC(=C(C=C4)O)O)O)O)O)O.

What is the CAS number of Isoacteoside?

The CAS number of Isoacteoside is 61303-13-7.

How many hydrogen bond donor counts does Isoacteoside have?

Isoacteoside has 9 hydrogen bond donor counts.

How many hydrogen bond acceptor counts does Isoacteoside have?

Isoacteoside has 15 hydrogen bond acceptor counts.

Synthetic Use

Upstream Synthesis Route 1

• 61276-17-3

• 61303-13-7

Reference: [1] Journal of Agricultural and Food Chemistry, 2001, vol. 49, # 6, p. 3113 - 3119
[2] Zeitschrift fuer Naturforschung, Teil B: Anorganische Chemie, Organische Chemie, 1982, vol. 37, # 12, p. 1633 - 1635

Upstream Synthesis Route 2

• 61276-17-3

• 61303-13-7

Reference: [1]Journal of Agricultural and Food Chemistry,2001,vol. 49,p. 3113 - 3119
[2]Zeitschrift fur Naturforschung, Teil B: Anorganische Chemie, Organische Chemie,1982,vol. 37,p. 1633 - 1635