Structure Info
- Chemspace ID
- CSCS00159262715 (Synthesis)
- MFCD
- MFCD21363102, MFCD33029329
- IUPAC Name
- (2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-({[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}methyl)oxan-2-yl (4aS,6aS,6bR,8aR,9R,10S,12aR,12bR,14bS)-10-{[(2S,3R,4S,5S)-3-{[(2S,3R,4R,5S,6S)-3,5-dihydroxy-6-methyl-4-{[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}oxan-2-yl]oxy}-4,5-dihydroxyoxan-2-yl]oxy}-9-(hydroxymethyl)-2,2,6a,6b,9,12a-hexamethyl-1,2,3,4,4a,5,6,6a,6b,7,8,8a,9,10,11,12,12a,12b,13,14b-icosahydropicene-4a-carboxylate
- Mol formula
- C59H96O27
- Mol weight
- 1237 Da
- Catalog Number(s)
- 41983, 41983-0.1G, 41983-0.5G, AA009BY0, ArZ-UP480980, CFN90672, CSC159262715, FM74009, HY-N2109, M18000, S9175, T3858, Y1233966, ZX-CY002756, ZXC171391
- Copy structure to query editor
- SMILES
- INCHI
- INCHI key
- MOL
Properties
- LogP
- -2.36
- Heavy atoms count
- 86
- Rotatable bond count
- 15
- Number of rings
- 10
- Carbon bond saturation, Fsp3
- 0.949
- Polar surface area (Å)
- 433
- Hydrogen bond acceptors count
- 26
- Hydrogen bond donors count
- 16
- Zoom the structure
- CSCS00159262715
Items Overall 2 items from 2 suppliers
Supplier | Lead time | Ships from | Purity | Pack | Price, € | Qty |
---|---|---|---|---|---|---|
Selleck Chemicals GmbH | 10 days | Germany To: | 97 | 1 mg | 169 | |
Description: CAS: 140360-29-8 | ||||||
Molnova Chemicals | TBD | United States To: | 98 | 5 mg | 97 | |
Description: macranthoidin A; CAS: 140360-29-8 |
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