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N-[17-(1-acetamidoethyl)-10-methyl-13-methylol-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-yl]acetamide
SpectraBase Compound ID 20o3Z5lXfnE
InChI InChI=1S/C25H40N2O3/c1-15(26-16(2)29)21-7-8-23-20-6-5-18-13-19(27-17(3)30)9-11-24(18,4)22(20)10-12-25(21,23)14-28/h5,15,19-23,28H,6-14H2,1-4H3,(H,26,29)(H,27,30)
InChIKey VLUFCMPECAQQRW-UHFFFAOYSA-N
Mol Weight 416.6 g/mol
Molecular Formula C25H40N2O3
Exact Mass 416.303893 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8mXS3UIFJjh
Name N-[17-(1-acetamidoethyl)-10-methyl-13-methylol-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-yl]acetamide
CAS Registry Number 55555-60-7
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C25H40N2O3
InChI InChI=1S/C25H40N2O3/c1-15(26-16(2)29)21-7-8-23-20-6-5-18-13-19(27-17(3)30)9-11-24(18,4)22(20)10-12-25(21,23)14-28/h5,15,19-23,28H,6-14H2,1-4H3,(H,26,29)(H,27,30)
InChIKey VLUFCMPECAQQRW-UHFFFAOYSA-N
Molecular Weight 416.606 g/mol
SMILES OCC12C(C(NC(C)=O)C)CCC2C2C(CC1)C1(C)C(=CC2)CC(CC1)NC(C)=O
SPLASH splash10-002u-9212000000-75e9e88654b3aaed5848
Source of Spectrum O-5-177-7
Synonyms N-[17-(1-acetamidoethyl)-13-(hydroxymethyl)-10-methyl-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-yl]acetamide N-[17-(1-acetamidoethyl)-13-(hydroxymethyl)-10-methyl-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-yl]ethanamide
Wiley ID 58452