Products 912329-03-4

CAS 912329-03-4 is the registry number for Karavilagenin A. Offered by: Biosynth, MedChemExpress. Available pack sizes: 1mg, 5mg, 10mg, Get quote.

Karavilagenin A
Biosynth, MedChemExpress
  • size: 1mg, 5mg, 10mg, Get quote
  • Variants: 4
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Structural formula: {0} (CAS {1})

(3S,7S,8R,9S,10S,13R,14S,17R)-7-methoxy-17-[(E,2R)-6-methoxy-6-methylhept-4-en-2-yl]-4,4,9,13,14-pentamethyl-2,3,7,8,10,11,12,15,16,17-decahydro-1H-cyclopenta[a]phenanthren-3-ol (CAS 912329-03-4) is a chemical compound with the molecular formula C32H54O3 and a molecular weight of 486.8 g/mol. IUPAC name: (3S,7S,8R,9S,10S,13R,14S,17R)-7-methoxy-17-[(E,2R)-6-methoxy-6-methylhept-4-en-2-yl]-4,4,9,13,14-pentamethyl-2,3,7,8,10,11,12,15,16,17-decahydro-1H-cyclopenta[a]phenanthren-3-ol. InChIKey: OJXKMMLNVLFMJM-QTACYZFBSA-N.

Identity
Molecular formulaC32H54O3
Molecular weight486.8 g/mol
IUPAC name(3S,7S,8R,9S,10S,13R,14S,17R)-7-methoxy-17-[(E,2R)-6-methoxy-6-methylhept-4-en-2-yl]-4,4,9,13,14-pentamethyl-2,3,7,8,10,11,12,15,16,17-decahydro-1H-cyclopenta[a]phenanthren-3-ol
InChIKeyOJXKMMLNVLFMJM-QTACYZFBSA-N
SMILESC[C@H](C/C=C/C(C)(C)OC)[C@H]1CC[C@@]2([C@@]1(CC[C@@]3([C@H]2[C@H](C=C4[C@H]3CC[C@@H](C4(C)C)O)OC)C)C)C

Computed by PubChem (NCBI)

Synonyms: 3beta-hydroxy-7beta,25-dimethoxycucurbita-5,23(E)-diene, Karavilagenin A, orb1680795, (23E)-7-b,25-Dimethoxycucurbita-5,23-dien-3-b-ol
Isomers (same molecular formula)
[(5S,8R,9S,10S,13S,14S,17S)-10,13-dimethyl-3-oxo-1,2,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydrocyclopenta[a]phenanthren-17-yl] tridecanoate C32H54O3
[4-methoxy-2,3,6-trimethyl-5-[(E)-3,7,11,15-tetramethylhexadec-2-enyl]phenyl] acetate C32H54O3
[(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] 2-methylpropyl carbonate C32H54O3
butyl [(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] carbonate C32H54O3