For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.
Methyl 7-(3-Acetoxypropyloxy)-4-[(S)-2-(benzyloxy)-3-(methanesulfonyloxy)propyl]-5-(methoxycarbonyl)amino]-1H-indole-2-carboxylate
SpectraBase Compound ID JqWt9SXQ3oh
InChI InChI=1S/C28H34N2O11S/c1-18(31)38-11-8-12-39-25-15-23(30-28(33)37-3)21(22-14-24(27(32)36-2)29-26(22)25)13-20(17-41-42(4,34)35)40-16-19-9-6-5-7-10-19/h5-7,9-10,14-15,20,29H,8,11-13,16-17H2,1-4H3,(H,30,33)/t20-/m0/s1
InChIKey QIFJDFKWDGKOAE-FQEVSTJZSA-N
Mol Weight 606.6 g/mol
Molecular Formula C28H34N2O11S
Exact Mass 606.188331 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID I5uTpMbnWVl
Name Methyl 7-(3-Acetoxypropyloxy)-4-[(S)-2-(benzyloxy)-3-(methanesulfonyloxy)propyl]-5-(methoxycarbonyl)amino]-1H-indole-2-carboxylate
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C28H34N2O11S
InChI InChI=1S/C28H34N2O11S/c1-18(31)38-11-8-12-39-25-15-23(30-28(33)37-3)21(22-14-24(27(32)36-2)29-26(22)25)13-20(17-41-42(4,34)35)40-16-19-9-6-5-7-10-19/h5-7,9-10,14-15,20,29H,8,11-13,16-17H2,1-4H3,(H,30,33)/t20-/m0/s1
InChIKey QIFJDFKWDGKOAE-FQEVSTJZSA-N
Molecular Weight 606.643 g/mol
SMILES [nH]1c(cc2c(c(cc(c12)OCCCOC(=O)C)NC(=O)OC)C[C@@](COS(=O)(=O)C)(OCc1ccccc1)[H])C(=O)OC
SPLASH splash10-0udl-5900010000-7f51c66aa2357dc4ce76
Source of Spectrum E1-46-570-59
Synonyms 7-(3-acetyloxypropoxy)-5-(methoxycarbonylamino)-4-[(2S)-3-methylsulfonyloxy-2-phenylmethoxypropyl]-1H-indole-2-carboxylic acid methyl ester Methyl 7-(3-acetyloxypropoxy)-5-(methoxycarbonylamino)-4-[(2S)-3-methylsulfonyloxy-2-phenylmethoxypropyl]-1H-indole-2-carboxylate Methyl 7-(3-acetoxypropoxy)-4-[(2S)-2-benzyloxy-3-methylsulfonyloxy-propyl]-5-(methoxycarbonylamino)-1H-indole-2-carboxylate Methyl 7-(3-acetyloxypropoxy)-5-(methoxycarbonylamino)-4-[(2S)-3-methylsulfonyloxy-2-phenylmethoxy-propyl]-1H-indole-2-carboxylate
Wiley ID 1554301