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Sanggenol D

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Sanggenol D
SpectraBase Compound ID DoKMV3ufMwH
InChI InChI=1S/C30H36O7/c1-16(2)7-6-8-18(5)10-12-21-26(33)19(11-9-17(3)4)13-22(27(21)34)30-29(36)28(35)25-23(32)14-20(31)15-24(25)37-30/h7,9-10,13-15,29-34,36H,6,8,11-12H2,1-5H3/b18-10+/t29-,30+/m0/s1
InChIKey HCAWJGVYBDDVDC-KGCSWYIWSA-N
Mol Weight 508.6 g/mol
Molecular Formula C30H36O7
Exact Mass 508.246103 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 46Y6MD7DiaZ
Name Sanggenol D
Alternate Name(s) (2R,3R)-2-[3-[(2E)-3,7-dimethyl-2,6-octadienyl]-2,4-dihydroxy-5-(3-methyl-2-butenyl)phenyl]-3,5,7-trihydroxy-2,3-dihydro-4H-chromen-4-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C30H36O7
InChI InChI=1S/C30H36O7/c1-16(2)7-6-8-18(5)10-12-21-26(33)19(11-9-17(3)4)13-22(27(21)34)30-29(36)28(35)25-23(32)14-20(31)15-24(25)37-30/h7,9-10,13-15,29-34,36H,6,8,11-12H2,1-5H3/b18-10+/t29-,30+/m0/s1
InChIKey HCAWJGVYBDDVDC-KGCSWYIWSA-N
Molecular Weight 508.611 g/mol
SMILES Oc1cc2O[C@@]([C@](C(c2c(c1)O)=O)(O)[H])(c1c(c(C\C=C\(CCC=C(C)C)C)c(c(c1)CC=C(C)C)O)O)[H]
SPLASH splash10-1029-3692100000-054a3679ecaf55f252fe
Source of Spectrum H1-43-434-4
Wiley ID 757768