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(16R) Ethyl 3,16-diacetoxy-20-methyl-24-nor-chol-5-en-23-oate
SpectraBase Compound ID LwMMjZVaTPR
InChI InChI=1S/C29H44O6/c1-7-33-26(32)14-17(2)27-25(35-19(4)31)16-24-22-9-8-20-15-21(34-18(3)30)10-12-28(20,5)23(22)11-13-29(24,27)6/h8,17,21-25,27H,7,9-16H2,1-6H3/t17?,21?,22?,23?,24?,25-,27?,28?,29?/m1/s1
InChIKey YQCDSSNEBKVWRD-LFGXHHMJSA-N
Mol Weight 488.7 g/mol
Molecular Formula C29H44O6
Exact Mass 488.313789 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3Qey19dm08
Name (16R) Ethyl 3,16-diacetoxy-20-methyl-24-nor-chol-5-en-23-oate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C29H44O6
InChI InChI=1S/C29H44O6/c1-7-33-26(32)14-17(2)27-25(35-19(4)31)16-24-22-9-8-20-15-21(34-18(3)30)10-12-28(20,5)23(22)11-13-29(24,27)6/h8,17,21-25,27H,7,9-16H2,1-6H3/t17?,21?,22?,23?,24?,25-,27?,28?,29?/m1/s1
InChIKey YQCDSSNEBKVWRD-LFGXHHMJSA-N
Molecular Weight 488.665 g/mol
SMILES C12(C(C3CC=C4C(C3CC2)(CCC(OC(=O)C)C4)C)C[C@](C1C(CC(=O)OCC)C)(OC(=O)C)[H])C
SPLASH splash10-0059-0002900000-45d21d46d76e0d5632bd
Source of Spectrum X4-18-576-0
Synonyms Ethyl 3,16-diacetoxy-20-hydroxy-24-nor-chol-5-en-23-oate Ethyl 3-[(13R)-5,13-bis(acetyloxy)-2,15-dimethyltetracyclo[8.7.0.0(2,7).0(11,15)]heptadec-7-en-14-yl]butanoate
Wiley ID 1585567