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CAS RN 2222-07-3

H3CCH3HOO(R)H3COH(R)(R)HO(S)CH3(S)(R)OHOCH3H3C(R)CH3O(R)H3C(E)

CAS RN 2222-07-3

IUPAC Name: (1R,2R,3aS,3bS,9aR,9bR,11aR)-1-[(2R,4E)-2,6-dihydroxy-6-methyl-3-oxohept-4-en-2-yl]-2,8-dihydroxy-3a,6,6,9b,11a-pentamethyl-1H,2H,3H,3aH,3bH,4H,6H,7H,9aH,9bH,10H,11H,11aH-cyclopenta[a]phenanthrene-7,10-dione
Synonyms: cucurbitacin cucurbitacin I cucurbitacin i elatericin B cucurbitacine (I) cucurbitacine (i) 1,2-dehydroelatericin A
Molecular Weight (g/mol): 514.66
Molecular Formula: C30H42O7
InChi Key: NISPVUDLMHQFRQ-MKIKIEMVSA-N
SMILES: CC(C)(O)\C=C\C(=O)[C@](C)(O)[C@H]1[C@H](O)C[C@@]2(C)[C@@H]3CC=C4[C@@H](C=C(O)C(=O)C4(C)C)[C@]3(C)C(=O)C[C@]12C

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