Basic information
- Standard SMILES
C[C@H]1CC[C@@]2(OC1)O[C@H]1C[C@H]3[C@@H]4CC=C5C[C@@H](O)C[C@@H](O[C@@H]6O[C@H](C)[C@H](O)[C@H](O)[C@H]6O)[C@]5(C)[C@H]4CC[C@]3(C)[C@H]1[C@@H]2C- InChIKey
KIAIAZNJHWWAFM-LZUXFAODSA-N- Molecular formula
- C33H52O8
- Average molar mass
- 576.8 g/mol
- Monoisotopic mass
- 576.36621862
Overview
(25s)-spirost-5-ene-1beta,3beta-diol 1-O-beta-d-fucopyranoside has been reported in Nolina microcarpa with data available.
Names & identifiers
- Preferred name
- (25s)-spirost-5-ene-1beta,3beta-diol 1-O-beta-d-fucopyranoside
- IUPAC
- (2R,3R,4S,5R,6R)-2-[(1S,2S,4S,5'S,6R,7S,8R,9S,12S,13R,14R,16R)-16-hydroxy-5',7,9,13-tetramethylspiro[5-oxapentacyclo[10.8.0.02,9.04,8.013,18]icos-18-ene-6,2'-oxane]-14-yl]oxy-6-methyloxane-3,4,5-triol
Names & synonyms
(25s)-spirost-5-ene-1beta,3beta-diol 1-O-beta-d-fucopyranoside
Properties
Computed structural properties
- XLogP
- 3.6
- Topological polar surface area
- 118 Ų
- Hydrogen bond donors
- 4
- Hydrogen bond acceptors
- 8
- Rotatable bonds
- 2
- Heavy atoms
- 41
- Formal charge
- 0
- Complexity
- 1,050
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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