Damulin A

• CAT Number: I045063
• CAS Number: 1202868-74-3
• Molecular Formula: C42H70O13
• Molecular Weight: 783.00
• Purity: ≥95%
• Synonyms: (2S,3R,4S,5S,6R)-2-[(2R,3R,4S,5S,6R)-2-[[(2R,3R,5R,8R,9R,10R,12R,13R,14R,17S)-2,12-dihydroxy-4,4,8,10,14-pentamethyl-17-[(2E)-6-methylhepta-2,5-dien-2-yl]-2,3,5,6,7,9,11,12,13,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-yl]oxy]-4,5-dihydroxy-6-(hydroxymethyl)oxan-3-yl]oxy-6-(hydroxymethyl)oxane-3,4,5-triol
• InChI: InChI=1S/C42H70O13/c1-20(2)10-9-11-21(3)22-12-14-42(8)29(22)23(45)16-28-40(6)17-24(46)36(39(4,5)27(40)13-15-41(28,42)7)55-38-35(33(50)31(48)26(19-44)53-38)54-37-34(51)32(49)30(47)25(18-43)52-37/h10-11,22-38,43-51H,9,12-19H2,1-8H3/b21-11+/t22-,23-,24-,25-,26-,27+,28-,29+,30-,31-,32+,33+,34-,35-,36+,37+,38+,40+,41-,42-/m1/s1
• InChIKey: BMSPHMYCTYOUPF-SNVBIOCGSA-N
• SMILES: CC(=CCC=C(C)C1CCC2(C1C(CC3C2(CCC4C3(CC(C(C4(C)C)OC5C(C(C(C(O5)CO)O)O)OC6C(C(C(C(O6)CO)O)O)O)O)C)C)O)C)C

Damulin A is a saponin found in G. pentaphyllum with anti-cancer activities[1].
Damulin A has anti-cancer activities and shows stronger cytotoxicity against A549 cells with an IC50 value of 59.2 μM[1].

Reference

[1]. Wei-Ye Cui, et al. Dammarane-type saponins from Gynostemma pentaphyllum and their cytotoxicities. Nat Prod Res. 2020 Feb 10;1-9.
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