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Sanggenol C
SpectraBase Compound ID Cut56MJdQmY
InChI InChI=1S/C30H36O6/c1-17(2)7-6-8-19(5)10-11-20-15-21(12-14-23(20)31)29-28(35)27(34)26-25(33)16-24(32)22(30(26)36-29)13-9-18(3)4/h7,9-10,12,14-16,28-29,31-33,35H,6,8,11,13H2,1-5H3/b19-10+/t28-,29+/m0/s1
InChIKey YQTHMAXSLMBWGP-JKDFNBTQSA-N
Mol Weight 492.6 g/mol
Molecular Formula C30H36O6
Exact Mass 492.251189 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID AV3x1CN9AS5
Name Sanggenol C
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C30H36O6
InChI InChI=1S/C30H36O6/c1-17(2)7-6-8-19(5)10-11-20-15-21(12-14-23(20)31)29-28(35)27(34)26-25(33)16-24(32)22(30(26)36-29)13-9-18(3)4/h7,9-10,12,14-16,28-29,31-33,35H,6,8,11,13H2,1-5H3/b19-10+/t28-,29+/m0/s1
InChIKey YQTHMAXSLMBWGP-JKDFNBTQSA-N
Molecular Weight 492.612 g/mol
SMILES O[C@@]1([C@](Oc2c(c(cc(c2CC=C(C)C)O)O)C1=O)(c1cc(C\C=C\(CCC=C(C)C)C)c(cc1)O)[H])[H]
SPLASH splash10-014i-6941100000-a113adbd48a8faccbd00
Source of Spectrum H1-43-434-3
Synonyms (2R,3R)-2-[3-[(2E)-3,7-dimethylocta-2,6-dienyl]-4-hydroxy-phenyl]-3,5,7-trihydroxy-8-(3-methylbut-2-enyl)chroman-4-one (2R,3R)-2-[3-[(2E)-3,7-dimethylocta-2,6-dienyl]-4-hydroxyphenyl]-3,5,7-trihydroxy-8-(3-methylbut-2-enyl)-2,3-dihydrochromen-4-one (2R,3R)-2-[3-[(2E)-3,7-dimethylocta-2,6-dienyl]-4-hydroxyphenyl]-3,5,7-trihydroxy-8-(3-methylbut-2-enyl)-3,4-dihydro-2H-1-benzopyran-4-one (2R,3R)-2-[3-[(2E)-3,7-dimethylocta-2,6-dienyl]-4-oxidanyl-phenyl]-8-(3-methylbut-2-enyl)-3,5,7-tris(oxidanyl)-2,3-dihydrochromen-4-one
Wiley ID 757769