Hopan-3-one

cas: 25615-11-6 — see every product listed under this CAS number, including other names

Hopan-3-one (CAS 25615-11-6) is a chemical reagent available from Chemat. Available pack sizes: 25mg. Offered by: TRC.

brandTRC
catalog numberTRC-H251810-25MG
cas25615-11-6
size25mg
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Structural formula: {0} (CAS {1})

(3S,3aS,5aR,5bR,7aR,11aR,11bR,13aR,13bS)-5a,5b,8,8,11a,13b-hexamethyl-3-prop-1-en-2-yl-2,3,3a,4,5,6,7,7a,10,11,11b,12,13,13a-tetradecahydro-1H-cyclopenta[a]chrysen-9-one (CAS 25615-11-6) is a chemical compound with the molecular formula C30H48O and a molecular weight of 424.7 g/mol. IUPAC name: (3S,3aS,5aR,5bR,7aR,11aR,11bR,13aR,13bS)-5a,5b,8,8,11a,13b-hexamethyl-3-prop-1-en-2-yl-2,3,3a,4,5,6,7,7a,10,11,11b,12,13,13a-tetradecahydro-1H-cyclopenta[a]chrysen-9-one. InChIKey: VEVKLOLYYQLRRV-WQPOQZFBSA-N.

Identity
Molecular formulaC30H48O
Molecular weight424.7 g/mol
IUPAC name(3S,3aS,5aR,5bR,7aR,11aR,11bR,13aR,13bS)-5a,5b,8,8,11a,13b-hexamethyl-3-prop-1-en-2-yl-2,3,3a,4,5,6,7,7a,10,11,11b,12,13,13a-tetradecahydro-1H-cyclopenta[a]chrysen-9-one
InChIKeyVEVKLOLYYQLRRV-WQPOQZFBSA-N
SMILESCC(=C)[C@H]1CC[C@]2([C@H]1CC[C@@]3([C@@H]2CC[C@H]4[C@]3(CC[C@@H]5[C@@]4(CCC(=O)C5(C)C)C)C)C)C

Computed by PubChem (NCBI)

Synonyms: Hopan-3-one, 3-Oxo-hop-22(29)-ene, Hop-22(29)-en-3-one, 17beta(H),21beta(H)-HOP-22(29)-EN-3-ONE, orb1744889, 17B(H),21B(H)-Hop-22(29)-en-3-one, Hop-22(29)-en-3-one, Hopenone b, A'-?Neogammaceran-?3-?one
Isomers (same molecular formula)
(4aR,6aR,6bS,8aR,12aR,14aR,14bR)-4,4,6a,6b,8a,11,11,14b-octamethyl-2,4a,5,6,7,8,9,10,12,12a,14,14a-dodecahydro-1H-picen-3-one C30H48O
(4aR,6aR,6bS,8aR,11R,12S,12aR,14aR,14bR)-4,4,6a,6b,8a,11,12,14b-octamethyl-1,2,4a,5,6,7,8,9,10,11,12,12a,14,14a-tetradecahydropicen-3-one C30H48O
(3aR,5aR,5bR,7aR,11aR,11bR,13aR,13bS)-5a,5b,8,8,11a,13b-hexamethyl-3-propan-2-ylidene-1,2,3a,4,5,6,7,7a,10,11,11b,12,13,13a-tetradecahydrocyclopenta[a]chrysen-9-one C30H48O
(1R,3aR,5aR,5bR,7aR,11aR,11bR,13aR,13bR)-3a,5a,5b,8,8,11a-hexamethyl-1-prop-1-en-2-yl-2,3,4,5,6,7,7a,10,11,11b,12,13,13a,13b-tetradecahydro-1H-cyclopenta[a]chrysen-9-one C30H48O

Also listed as

Hop-22(29)-en-3-one TRC CAS 25615-11-6
3-Oxo-hop-22(29)-ene MedChemExpress CAS 25615-11-6