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Name:(E)-(S)-4-[(S)-2-((S)-2-TERT-BUTOXYCARBONYLAMINO-3-METHYL-BUTYRYLAMINO)-2-PHENYL-ACETYLAMINO]-5-(2-OXO-PYRROLIDIN-3-YL)-PENT-2-ENOIC ACID ETHYL ESTER
PubChem ID:6323298
Pathway:-
InChI:InChI=1/C29H42N4O7/c1-7-39-22(34)14-13-21(17-20-15-16-30-25(20)35)31-27(37)24(19-11-9-8-10-12-19)32-26(36)23(18(2)3)33-28(38)40-29(4,5)6/h8-14,18,20-21,23-24H,7,15-17H2,1-6H3,(H,30,35)(H,31,37)(H,32,36)(H,33,38)/b14-13-/t20-,21+,23-,24-/m0/s1/f/h30-33H
SMILES:CCOC(C(=C(/[H])[C@@H](C[C@@H]1(CCNC1=O))NC([C@@H](c1ccccc1)NC([C@@H](C(C)C)NC(=O)OC(C)(C)C)=O)=O)/[H])=O

Properties:
Formula:C29H42N4O7Atoms:46
Molecular Weight:558.666Rotatable Bonds:18
H-bond Acceptors:11H-bond Donors:0
logP:4.025
Targets:
NameUniprot IDSourceReferencesInteraction
Replicase polyprotein 1abR1AB_CVHSADrugBank-shows
Synonyms:
(E)-(S)-4-[(S)-2-((S)-2-TERT-BUTOXYCARBONYLAMINO-3-METHYL-BUTYRYLAMINO)-2-
(E)-(S)-4-[(S)-2-((S)-2-TERT-BUTOXYCARBONYLAMINO-3-METHYL-BUTYRYLAMINO)-2-PHENYL-ACETYLAMINO]-5-(2-OXO-PYRROLIDIN-3-YL)-PENT-2-ENOIC ACID ETHYL ESTER
AC1O43PD
CID6323298
ENB
ETHYL (2E,4S)-4-[((2R)-2-{[N-(TERT-BUTOXYCARBONYL)-L-VALYL]AMINO}-2-PHENYLETHANOYL)AMINO]-5-[(3S)-2-OXOPYRROLIDIN-3-YL]PENT-2-ENOATE