Primary Record
SCHEMBL16303285
- In stock
- 9,602 g
- Purity
- 98.8 %
- CAS
- 55721-31-8
Compound Identifiers & Properties
- CAS
- 55721-31-8
- PubChem CID
- 117746701
- SMILES
- CC[C@@H](C=O)[C@H]1CC[C@@H]([C@@H](O1)[C@@H](C)[C@@H]([C@H](C)C(=O)[C@H](CC)[C@@H]2[C@H](C[C@H]([C@]3(O2)C=C[C@H]([C@@]4(O3)CC[C@@](O4)(C)[C@H]5CC[C@@]([C@@H](O5)C)(CC)O)O)C)C)O)C
- Canonical SMILES
- CC[C@@H](C=O)[C@H]1CC[C@H](C)[C@H]([C@@H](C)[C@H](O)[C@H](C)C(=O)[C@H](CC)[C@H]2O[C@]3(C=C[C@@H](O)[C@]4(CC[C@@](C)([C@H]5CC[C@](O)(CC)[C@H](C)O5)O4)O3)[C@H](C)C[C@@H]2C)O1
Names & Synonyms
- SCHEMBL16303285
- 2H-Pyran-2-acetic acid, .alpha.-ethyl-6-[(1S,2S,3S,5R)-5-[(2S,5S,7R,9S,10S,12R,15R)-2-[(5R,6S)-5-ethyltetrahydro-5-hydroxy-6-methyl-2H-pyran-2-yl]-15-hydroxy-2,10,12-trimethyl-1,6,8-trioxadispiro[4.1.5. 3]pentadec-13-en-9-yl]-2-hydroxy-1,3-dimethyl-4-oxoheptyl]tetrahydro-5-methyl-,?sodium salt, (.alpha.R,2R,5S,6R)-, hydrate?(1:1:1)
- 55721-31-8