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14,20-Cycloveatchane-2,5,6,11,12-pentol, 4,21-dimethyl-16-methylene-, 6,11,12-triacetate, (2.alpha.,6.alpha.,11.alpha.,12.alpha.)-
SpectraBase Compound ID D2kJh79uL0e
InChI InChI=1S/C27H37NO8/c1-12-7-25-10-17(34-13(2)29)27(33)24(5)8-16(32)9-26(27)22(25)21(36-15(4)31)20(35-14(3)30)18(12)19(25)23(26)28(6)11-24/h16-23,32-33H,1,7-11H2,2-6H3/t16-,17+,18+,19+,20+,21+,22+,23+,24+,25+,26+,27-/m0/s1
InChIKey CJYKDYLXIADSOL-HJKVUHRJSA-N
Mol Weight 503.6 g/mol
Molecular Formula C27H37NO8
Exact Mass 503.251917 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8FwNbGiGvZi
Name 14,20-Cycloveatchane-2,5,6,11,12-pentol, 4,21-dimethyl-16-methylene-, 6,11,12-triacetate, (2.alpha.,6.alpha.,11.alpha.,12.alpha.)-
CAS Registry Number 60783-14-4
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C27H37NO8
InChI InChI=1S/C27H37NO8/c1-12-7-25-10-17(34-13(2)29)27(33)24(5)8-16(32)9-26(27)22(25)21(36-15(4)31)20(35-14(3)30)18(12)19(25)23(26)28(6)11-24/h16-23,32-33H,1,7-11H2,2-6H3/t16-,17+,18+,19+,20+,21+,22+,23+,24+,25+,26+,27-/m0/s1
InChIKey CJYKDYLXIADSOL-HJKVUHRJSA-N
Molecular Weight 503.592 g/mol
SMILES O[C@]1(C[C@@]2(CN([C@@]3([C@]4([C@]5(C(C[C@]44[C@]([C@]3([C@@]2([C@@](C4)(OC(=O)C)[H])O)C1)([C@@]([C@@]5(OC(=O)C)[H])(OC(=O)C)[H])[H])=C)[H])[H])[H])C)C)[H]
SPLASH splash10-0f8c-5009500000-38c1436965033ced6ccc
Source of Spectrum B-29-1315-0
Synonyms 2H,7H-7,10-Ethano-7a,3,6a-[1]propanyl[3]ylidenepentaleno[1,2-b]azocine, 14,20-cycloveatchane-2,5,6,11,12-pentol deriv. (1R,3R,4S,5R,7S,9R,12S,13R,14R,15R,16S,17S)-15,16-bis(acetyloxy)-4,7-dihydroxy-9,11-dimethyl-19-methylene-11-azahexacyclo[12.3.2.0(1,13).0(4,9).0(5,12).0(5,17)]nonadec-3-yl acetate 6.beta.,11.alpha.,12.alpha.-triacetoxy-19,20-methylimino-14,20-cyclo-ent-kaur-16-ene-2.alpha.,5.beta.-diol
Wiley ID 1399398