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1H-Cyclopenta[a]cyclopropa[e]phenanthrene-2,5,7-triol, 1-(4,5-dihydroxy-1,5-dimethylhexyl)tetradecahydro-3a,6,6,12a-tetramethyl-
SpectraBase Compound ID JlhRG0xYHYC
InChI InChI=1S/C30H52O5/c1-17(8-9-22(34)26(4,5)35)23-19(32)15-28(7)20-14-18(31)24-25(2,3)21(33)10-11-30(24)16-29(20,30)13-12-27(23,28)6/h17-24,31-35H,8-16H2,1-7H3/t17-,18+,19?,20?,21?,22?,23?,24?,27-,28+,29?,30?/m1/s1
InChIKey NNYKOYIGBZQYAI-BQAALMBGSA-N
Mol Weight 492.7 g/mol
Molecular Formula C30H52O5
Exact Mass 492.381475 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HdAllVmIU0w
Name 1H-Cyclopenta[a]cyclopropa[e]phenanthrene-2,5,7-triol, 1-(4,5-dihydroxy-1,5-dimethylhexyl)tetradecahydro-3a,6,6,12a-tetramethyl-
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Formula C30H52O5
InChI InChI=1S/C30H52O5/c1-17(8-9-22(34)26(4,5)35)23-19(32)15-28(7)20-14-18(31)24-25(2,3)21(33)10-11-30(24)16-29(20,30)13-12-27(23,28)6/h17-24,31-35H,8-16H2,1-7H3/t17-,18+,19?,20?,21?,22?,23?,24?,27-,28+,29?,30?/m1/s1
InChIKey NNYKOYIGBZQYAI-BQAALMBGSA-N
Molecular Weight 492.741 g/mol
SMILES OC1C(C2C3(C4(CC[C@@]5(C([C@@](CCC(C(O)(C)C)O)(C)[H])C(C[C@]5(C4C[C@@]2(O)[H])C)O)C)C3)CC1)(C)C
SPLASH splash10-0006-9500000000-fdda02120a05aeb3f2bb
Source of Spectrum IY-1-4697-7
Wiley ID 1654960