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11,12-Dihydroxy-17.beta.-methoxy-10-isopropyl-Abieta-8,11,12-trien-20-oic Acid-20,6-Lactone
SpectraBase Compound ID 8Vw6kVWUJBl
InChI InChI=1S/C21H28O5/c1-10(2)11-9-12-13(15(23)14(11)22)21-8-6-7-20(3,4)18(21)17(16(12)25-5)26-19(21)24/h9-10,16-18,22-23H,6-8H2,1-5H3/t16-,17-,18+,21+/m1/s1
InChIKey XNPVHIQPSAZTLC-WIRSXHRWSA-N
Mol Weight 360.45 g/mol
Molecular Formula C21H28O5
Exact Mass 360.193674 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID ITL9GWemDo
Name 11,12-Dihydroxy-17.beta.-methoxy-10-isopropyl-Abieta-8,11,12-trien-20-oic Acid-20,6-Lactone
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H28O5
InChI InChI=1S/C21H28O5/c1-10(2)11-9-12-13(15(23)14(11)22)21-8-6-7-20(3,4)18(21)17(16(12)25-5)26-19(21)24/h9-10,16-18,22-23H,6-8H2,1-5H3/t16-,17-,18+,21+/m1/s1
InChIKey XNPVHIQPSAZTLC-WIRSXHRWSA-N
Molecular Weight 360.450 g/mol
SMILES Oc1c(c(cc2[C@]([C@]3(OC([C@@]4(c12)[C@@]3(C(CCC4)(C)C)[H])=O)[H])(OC)[H])C(C)C)O
SPLASH splash10-0ay1-3591000000-7fa761179d08c6c54182
Source of Spectrum G4-72-1388-7
Synonyms 7.beta.-methyl-rosmanol
Wiley ID 1702215