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trans-6,7-Dihydro-7-(4-hydroxy-3-methoxyphenyl)-4,9-dimethoxy-2,11-dipropyl-dibenzo[e,g][1,4]dioxocin-6-ylmethanol
SpectraBase Compound ID F15DeDWc7IY
InChI InChI=1S/C30H36O7/c1-6-8-18-12-21-22-13-19(9-7-2)15-26(35-5)30(22)37-28(20-10-11-23(32)24(16-20)33-3)27(17-31)36-29(21)25(14-18)34-4/h10-16,27-28,31-32H,6-9,17H2,1-5H3/t27-,28-/m1/s1
InChIKey JTGIDQWOKFTOIY-VSGBNLITSA-N
Mol Weight 508.6 g/mol
Molecular Formula C30H36O7
Exact Mass 508.246103 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID LXClp2t0M2J
Name Trans-6,7-dihydro-7-(4-hydroxy-3-methoxyphenyl)-4,9-dimethoxy-2,11-dipropyl-dibenzo[E,G][1,4]dioxocin-6-ylmethanol
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 508.246103492 u
Formula C30H36O7
InChI InChI=1S/C30H36O7/c1-6-8-18-12-21-22-13-19(9-7-2)15-26(35-5)30(22)37-28(20-10-11-23(32)24(16-20)33-3)27(17-31)36-29(21)25(14-18)34-4/h10-16,27-28,31-32H,6-9,17H2,1-5H3/t27-,28-/m1/s1
InChIKey JTGIDQWOKFTOIY-VSGBNLITSA-N
Molecular Weight 508.611 g/mol
SMILES C=12C=3C(O[C@@]([C@](OC2=C(OC)C=C(C1)CCC)(CO)[H])(C=1C=C(OC)C(=CC1)O)[H])=C(OC)C=C(C3)CCC