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Cryptophycin-26
SpectraBase Compound ID 6gMoP44xweI
InChI InChI=1S/C35H45ClN2O8/c1-21(2)15-31-35(43)45-26(18-29(39)22(3)11-12-24-9-7-6-8-10-24)19-32(40)38-28(33(41)37-20-23(4)34(42)46-31)17-25-13-14-30(44-5)27(36)16-25/h6-14,16,21-23,26,28-29,31,39H,15,17-20H2,1-5H3,(H,37,41)(H,38,40)/b12-11+/t22-,23-,26+,28-,29+,31+/m1/s1
InChIKey JVTODUXHSHCQOJ-PAAQLZDGSA-N
Mol Weight 657.2 g/mol
Molecular Formula C35H45ClN2O8
Exact Mass 656.286444 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID IHixsNFWQsC
Name Cryptophycin-26
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C35H45ClN2O8
InChI InChI=1S/C35H45ClN2O8/c1-21(2)15-31-35(43)45-26(18-29(39)22(3)11-12-24-9-7-6-8-10-24)19-32(40)38-28(33(41)37-20-23(4)34(42)46-31)17-25-13-14-30(44-5)27(36)16-25/h6-14,16,21-23,26,28-29,31,39H,15,17-20H2,1-5H3,(H,37,41)(H,38,40)/b12-11+/t22-,23-,26+,28-,29+,31+/m1/s1
InChIKey JVTODUXHSHCQOJ-PAAQLZDGSA-N
Molecular Weight 657.204 g/mol
SMILES N1C(C[C@](C[C@@]([C@@](\C=C\c2ccccc2)(C)[H])(O)[H])(OC([C@@](OC([C@@](CNC([C@]1(Cc1cc(Cl)c(cc1)OC)[H])=O)(C)[H])=O)(CC(C)C)[H])=O)[H])=O
SPLASH splash10-001j-0930100000-161c231fe34b341fe7b3
Source of Spectrum C-117-12042-9
Synonyms (3S,6R,10R,14S)-10-(3-chloro-4-methoxybenzyl)-14-[(2S,3R,4E)-2-hydroxy-3-methyl-5-phenyl-4-pentenyl]-3-isobutyl-6-methyl-1,4-dioxa-8,11-diazacyclotetradecane-2,5,9,12-tetrone
Wiley ID 759280