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19-nor-Pregna-1,3,5(10),20-tetraen-3-O-.alpha.-arabinopyranoside
SpectraBase Compound ID AeFlXB6JY7U
InChI InChI=1S/C25H34O5/c1-3-15-5-9-20-19-7-4-14-12-16(30-24-23(28)22(27)21(26)13-29-24)6-8-17(14)18(19)10-11-25(15,20)2/h3,6,8,12,15,18-24,26-28H,1,4-5,7,9-11,13H2,2H3/t15-,18?,19?,20?,21+,22+,23?,24-,25+/m0/s1
InChIKey ZCSWAOOUEBJEKN-MQIFGWPBSA-N
Mol Weight 414.5 g/mol
Molecular Formula C25H34O5
Exact Mass 414.240624 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CwXfeUMQxtH
Name 19-nor-Pregna-1,3,5(10),20-tetraen-3-O-.alpha.-arabinopyranoside
Alternate Name(s) 2-[[(13R,17R)-17-ethenyl-13-methyl-6,7,8,9,11,12,14,15,16,17-decahydrocyclopenta[a]phenanthren-3-yl]oxy]oxane-3,4,5-triol
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Formula C25H34O5
InChI InChI=1S/C25H34O5/c1-3-15-5-9-20-19-7-4-14-12-16(30-24-23(28)22(27)21(26)13-29-24)6-8-17(14)18(19)10-11-25(15,20)2/h3,6,8,12,15,18-24,26-28H,1,4-5,7,9-11,13H2,2H3/t15-,18?,19?,20?,21+,22+,23?,24-,25+/m0/s1
InChIKey ZCSWAOOUEBJEKN-MQIFGWPBSA-N
Molecular Weight 414.542 g/mol
SMILES O[C@@]1([C@@](CO[C@](C1O)(Oc1ccc2C3CC[C@]4(C(C3CCc2c1)CC[C@@]4(C=C)[H])C)[H])(O)[H])[H]
SPLASH splash10-03e9-1190000000-f6010656d2b7fac74afb
Source of Spectrum G4-62-320-4
Wiley ID 1607758