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(-)-Balanocarpol
SpectraBase Compound ID KVy7zURdKAl
InChI InChI=1S/C28H22O7/c29-15-5-1-13(2-6-15)23-24-19(9-17(31)11-21(24)33)26-25-20(27(23)34)10-18(32)12-22(25)35-28(26)14-3-7-16(30)8-4-14/h1-12,23,26-34H/t23-,26+,27+,28-/m1/s1
InChIKey LHUHHURKGTUZHU-HBMTYJCASA-N
Mol Weight 470.48 g/mol
Molecular Formula C28H22O7
Exact Mass 470.136553 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6fzwZwDFPlh
Name (-)-Balanocarpol
Alternate Name(s) Beno[6,7]cycloheptal[1,2,3-cd]benzofuran-4,6,8,10-tetrol, 1,6,7,11b-tetrahydro-1,7-bis(4-hydroxyphenyl)-, (1R,6S,7S,11bR)-rel-(-)
CAS Registry Number 99646-13-6
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C28H22O7
InChI InChI=1S/C28H22O7/c29-15-5-1-13(2-6-15)23-24-19(9-17(31)11-21(24)33)26-25-20(27(23)34)10-18(32)12-22(25)35-28(26)14-3-7-16(30)8-4-14/h1-12,23,26-34H/t23-,26+,27+,28-/m1/s1
InChIKey LHUHHURKGTUZHU-HBMTYJCASA-N
Molecular Weight 470.477 g/mol
SMILES Oc1cc(cc2c1[C@]([C@](c1c3[C@]2([C@](Oc3cc(c1)O)(c1ccc(cc1)O)[H])[H])(O)[H])(c1ccc(cc1)O)[H])O
SPLASH splash10-0f6y-9116700000-fb8d059433e7fe1aae29
Source of Spectrum KC-1985-1809-2
Wiley ID 1392886