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1H-Naphtho[2,1-b]pyran, 2,5-hexadiene-1,4-diol deriv.
SpectraBase Compound ID Gw1YUjLkCMu
InChI InChI=1S/C31H48O7/c1-20(14-19-35-21(2)32)24(36-22(3)33)10-15-29(7)16-11-26-30(8)17-13-27(37-23(4)34)28(5,6)25(30)12-18-31(26,9)38-29/h10,14-15,24-27H,11-13,16-19H2,1-9H3/b15-10+,20-14+
InChIKey GCBPHQYVFRHAAP-HIWDHFBUSA-N
Mol Weight 532.7 g/mol
Molecular Formula C31H48O7
Exact Mass 532.340004 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HzECeOSTCez
Name 1H-Naphtho[2,1-b]pyran, 2,5-hexadiene-1,4-diol deriv.
CAS Registry Number 123844-66-6
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C31H48O7
InChI InChI=1S/C31H48O7/c1-20(14-19-35-21(2)32)24(36-22(3)33)10-15-29(7)16-11-26-30(8)17-13-27(37-23(4)34)28(5,6)25(30)12-18-31(26,9)38-29/h10,14-15,24-27H,11-13,16-19H2,1-9H3/b15-10+,20-14+
InChIKey GCBPHQYVFRHAAP-HIWDHFBUSA-N
Molecular Weight 532.718 g/mol
SMILES C12(C(C(C)(C)C(CC2)OC(=O)C)CCC2(C1CCC(\C=C\C(\C(=C\COC(=O)C)C)OC(=O)C)(C)O2)C)C
SPLASH splash10-053s-9300000000-5550e26e72217d9976e6
Source of Spectrum F-45-3582-8
Synonyms 2,5-Hexadiene-1,4-diol, 6-[8-(acetyloxy)dodecahydro-3,4a,7,7,10a-pentamethyl-1H-naphtho[2,1-b]pyran-3-yl]-3-methyl-, diacetate (2E)-4-(acetyloxy)-1-{(E)-2-[8-(acetyloxy)-3,4a,7,7,10a-pentamethyldodecahydro-1H-benzo[f]chromen-3-yl]ethenyl}-2-methyl-2-butenyl acetate 2,4b,8,8,10a-pentamethyl-7-hydroxy-2-(2-methoxy-2-(4'-methyl-2-oxo-furanyl)-ethenyl)-1-oxa-perhydro-phenanthrane
Wiley ID 1403630