Basic information
- CAS
37770-14-2- Standard SMILES
CC12CCC3C(CCC4CC5(CCC43C)SCCS5)C1CCC2O- InChIKey
AZGUMZVYIIAYNT-UHFFFAOYSA-N- Molecular formula
- C21H34OS2
- Average molar mass
- 366.6 g/mol
- Monoisotopic mass
- 366.20510805
Names & identifiers
- Preferred name
- 10,13-Dimethylhexadecahydrospiro[cyclopenta[a]phenanthrene-3,2'-[1,3]dithiolan]-17-ol
- IUPAC
- 10,13-dimethylspiro[1,2,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydrocyclopenta[a]phenanthrene-3,2'-1,3-dithiolane]-17-ol
Names & synonyms
37770-14-210,13-dimethylhexadecahydrospiro[cyclopenta[a]phenanthrene-3,2'-[1,3]dithiolan]-17-olNSC118999DTXSID40297896NSC134948NSC-118999NSC-1349489a,11a-Dimethylhexadecahydrospiro[cyclopenta[a]phenanthrene-7,2'-[1,3]dithiolan]-1-ol
Database identifiers
- CAS
37770-14-2- PubChem CID
- 273626
- DTXSID
DTXSID40297896
Properties
Computed structural properties
- XLogP
- 5.8
- Topological polar surface area
- 70.8 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 0
- Heavy atoms
- 24
- Formal charge
- 0
- Complexity
- 516
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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