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24s-Cycloartane-3.beta.,16.beta.,24,25-tetraol
SpectraBase Compound ID 7cMJZPE0kHy
InChI InChI=1S/C30H52O4/c1-18(8-11-23(33)26(4,5)34)24-19(31)16-28(7)21-10-9-20-25(2,3)22(32)12-13-29(20)17-30(21,29)15-14-27(24,28)6/h18-24,31-34H,8-17H2,1-7H3/t18?,19-,20-,21-,22-,23-,24-,27+,28-,29+,30-/m0/s1
InChIKey OQIVYZDWLWXFQI-XSMYOBMBSA-N
Mol Weight 476.7 g/mol
Molecular Formula C30H52O4
Exact Mass 476.38656 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 397FErk81bS
Name 24s-Cycloartane-3.beta.,16.beta.,24,25-tetraol
Alternate Name(s) (1R,2S,3aS,3bS,5aR,7S,9aR,10aS,12aR)-1-[(4S)-4,5-dihydroxy-1,5-dimethylhexyl]-3a,6,6,12a-tetramethyltetradecahydro-1H-cyclopenta[a]cyclopropa[e]phenanthrene-2,7-diol Cyclofoetigenin A
CAS Registry Number 97763-04-7
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C30H52O4
InChI InChI=1S/C30H52O4/c1-18(8-11-23(33)26(4,5)34)24-19(31)16-28(7)21-10-9-20-25(2,3)22(32)12-13-29(20)17-30(21,29)15-14-27(24,28)6/h18-24,31-34H,8-17H2,1-7H3/t18?,19-,20-,21-,22-,23-,24-,27+,28-,29+,30-/m0/s1
InChIKey OQIVYZDWLWXFQI-XSMYOBMBSA-N
Molecular Weight 476.742 g/mol
SMILES O[C@@]1(C([C@]2([C@@]3([C@@]4(CC[C@@]5([C@@](C(CC[C@@](C(O)(C)C)(O)[H])C)([C@](C[C@]5([C@@]4(CC2)[H])C)(O)[H])[H])C)C3)CC1)[H])(C)C)[H]
SPLASH splash10-052f-2316900000-786aa3c6e65927c41628
Source of Spectrum X4-21-348-0
Wiley ID 1585810