Sarmentoside D
Basic information
- CAS
11005-45-1- Standard SMILES
CC1O[C@H](O[C@H]2CC[C@]3(C=O)C4C(CC[C@]3(O)C2)[C@@]2(O)CC[C@H](C3=CC(=O)OC3)[C@@]2(C)C[C@H]4O)C(O)C(O)[C@H]1O- InChIKey
AZOXLPPOBHVORY-RJSIGILSSA-N- Molecular formula
- C29H42O11
- Average molar mass
- 566.6 g/mol
- Monoisotopic mass
- 566.27271215
Names & identifiers
- Preferred name
- Sarmentoside D
- IUPAC
- (3S,5S,10S,11R,13R,14S,17R)-5,11,14-trihydroxy-13-methyl-17-(5-oxo-2H-furan-3-yl)-3-[(2S,5R)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxy-2,3,4,6,7,8,9,11,12,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthrene-10-carbaldehyde
Names & synonyms
Sarmentosid DSarmentoside DSarmentosid D [German]11005-45-1RefChem:379891Sarmentoside ASarmentoside CSarmentosid A-rohrkristallisatSarmentoside A, crude crystallisate508-73-6Sarmentosid A-rohrkristallisat [German]DTXSID30911473
Show more names
Card-20(22)-enolide, 3-((6-deoxy-alpha-L-talopyranosyl)oxy)-5,11,14-trihydroxy-19-oxo-, (3-beta,5-beta,11-alpha)-3-[(6-Deoxyhexopyranosyl)oxy]-5,11,14-trihydroxy-19-oxocard-20(22)-enolide(8xi,9xi)-3beta-[(6-Deoxy-beta-L-glycero-hexopyranosyl)oxy]-5,11alpha,14-trihydroxy-19-oxo-5beta-card-20(22)-enolide
Database identifiers
- CAS
11005-45-1、508-73-6- PubChem CID
- 10501
- DTXSID
DTXSID30911473
Properties
Computed structural properties
- XLogP
- -1.8
- Topological polar surface area
- 183 Ų
- Hydrogen bond donors
- 6
- Hydrogen bond acceptors
- 11
- Rotatable bonds
- 4
- Heavy atoms
- 40
- Formal charge
- 0
- Complexity
- 1,080
Related reactions
0 records
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Compound notes
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