Cholesterol hydrogen phthalate

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Catalog Number
ACM6732010
Product Name
Cholesterol hydrogen phthalate
Structure
Structure
CAS
6732-01-0
Category
Steroidal Compounds
Synonyms
NSC59691, EINECS 229-783-9, CID111235, Cholest-5-en-3beta-yl hydrogen phthalate, 6732-01-0
IUPAC Name
2-[[(3S,8S,9S,10R,13R,14S,17R)-10,13-dimethyl-17-[(2R)-6-methylheptan-2-yl]-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-yl]oxycarbonyl]benzoic acid
Molecular Weight
534.77
Molecular Formula
C35H50O4
Canonical SMILES
CC(C)CCCC(C)C1CCC2C1(CCC3C2CC=C4C3(CCC(C4)OC(=O)C5=CC=CC=C5C(=O)O)C)C
InChI Key
DNRPYEJJPBQNQB-MMFRCHASSA-N
Boiling Point
631.8ºC at 760 mmHg
Melting Point
163ºC
Flash Point
191.8ºC
Density
1.11g/cm³
EC Number
229-783-9
Exact Mass
534.37100
H-Bond Acceptor
4
H-Bond Donor
1
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