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(25R)-Nuatigenin diacetate
SpectraBase Compound ID 77YZZv6a9Uy
InChI InChI=1S/C31H46O6/c1-18-27-26(36-31(18)14-13-28(4,37-31)17-34-19(2)32)16-25-23-8-7-21-15-22(35-20(3)33)9-11-29(21,5)24(23)10-12-30(25,27)6/h7,18,22-27H,8-17H2,1-6H3
InChIKey KKBVNPPUTWMILP-UHFFFAOYSA-N
Mol Weight 514.7 g/mol
Molecular Formula C31H46O6
Exact Mass 514.329439 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DoixsCiczfT
Name Furost-5-ene-3,26-diol, 22,25-epoxy-, diacetate, (3.beta.,22.alpha.,25S)-
Alternate Name(s) Nuatigenin diacetate Spiro[furan-2(3H),8'-[8H]naphth[2',1':4,5]indeno[2,1-b]furan], furost-5-ene-3,26-diol deriv.
CAS Registry Number 56196-24-8
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C31H46O6
InChI InChI=1S/C31H46O6/c1-18-27-26(36-31(18)14-13-28(4,37-31)17-34-19(2)32)16-25-23-8-7-21-15-22(35-20(3)33)9-11-29(21,5)24(23)10-12-30(25,27)6/h7,18,22-27H,8-17H2,1-6H3
InChIKey KKBVNPPUTWMILP-UHFFFAOYSA-N
Molecular Weight 514.703 g/mol
SMILES CC12C3C(OC4(C3C)OC(COC(C)=O)(C)CC4)CC2C2C(CC1)C1(C)C(=CC2)CC(CC1)OC(C)=O
SPLASH splash10-00lj-4920100000-ad6f726cf5577d334a87
Source of Spectrum CD-513-0-0
Wiley ID 1401172