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3,4,6,7,29-Pentahydroxy-22,29-epoxystigmastan-15-one

HCID 164397
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Basic informationNames & identifiersRelated reactionsCompound notes
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Basic information

CAS
137571-30-3
Standard SMILES
CC(C)[C@@H]1CC(O)O[C@@H]([C@@H](C)[C@H]2CC(=O)[C@@H]3[C@@H]4[C@@H](O)[C@H](O)[C@H]5[C@@H](O)[C@H](O)CC[C@]5(C)[C@H]4CC[C@]23C)C1
InChIKey
IRHVLQMEQPABHG-QUZWXNHXSA-N
Molecular formula
C29H48O7
Average molar mass
508.696 g/mol
Monoisotopic mass
508.34000388

Names & identifiers

Preferred name
3,4,6,7,29-Pentahydroxy-22,29-epoxystigmastan-15-one
IUPAC
(17R,22R,24S)-3alpha,4beta,6alpha,7beta,29-Pentahydroxy-5alpha,14beta-22,29-epoxystigmastan-15-one
English name
contignasterol
Molecular formula
C29H48O7
Molecular weight
508.691

Names & synonyms

contignasterol

Database identifiers

CAS
137571-30-3
PubChem CID
164397
DTXSID
DTXSID50929838

Related reactions

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Compound notes

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