(5S,8S)-36-methoxy-8-((5R,8S,11S,14S)-11-(4-methoxybenzyl)-N,5,8,10,14-pentamethyl-3,6,9,12-tetraoxo-1-phenyl-2-oxa-4,7,10,13-tetraazapentadecan-15-amido)-6-methyl-7-oxo-2-oxa-6-aza-1(1,4),3(1,3)-dibenzenacyclononaphane-5-carboxylic acid

Modify Date: 2024-01-18 14:25:49

(5S,8S)-36-methoxy-8-((5R,8S,11S,14S)-11-(4-methoxybenzyl)-N,5,8,10,14-pentamethyl-3,6,9,12-tetraoxo-1-phenyl-2-oxa-4,7,10,13-tetraazapentadecan-15-amido)-6-methyl-7-oxo-2-oxa-6-aza-1(1,4),3(1,3)-dibenzenacyclononaphane-5-carboxylic acid Structure
(5S,8S)-36-methoxy-8-((5R,8S,11S,14S)-11-(4-methoxybenzyl)-N,5,8,10,14-pentamethyl-3,6,9,12-tetraoxo-1-phenyl-2-oxa-4,7,10,13-tetraazapentadecan-15-amido)-6-methyl-7-oxo-2-oxa-6-aza-1(1,4),3(1,3)-dibenzenacyclononaphane-5-carboxylic acid structure
 Common Name (5S,8S)-36-methoxy-8-((5R,8S,11S,14S)-11-(4-methoxybenzyl)-N,5,8,10,14-pentamethyl-3,6,9,12-tetraoxo-1-phenyl-2-oxa-4,7,10,13-tetraazapentadecan-15-amido)-6-methyl-7-oxo-2-oxa-6-aza-1(1,4),3(1,3)-dibenzenacyclononaphane-5-carboxylic acid
CAS Number 115441-70-8 Molecular Weight 923.01800
Density N/A Boiling Point N/A
Molecular Formula C49H58N6O12 Melting Point N/A
MSDS N/A Flash Point N/A

 Names

Name (5S,8S)-36-methoxy-8-((5R,8S,11S,14S)-11-(4-methoxybenzyl)-N,5,8,10,14-pentamethyl-3,6,9,12-tetraoxo-1-phenyl-2-oxa-4,7,10,13-tetraazapentadecan-15-amido)-6-methyl-7-oxo-2-oxa-6-aza-1(1,4),3(1,3)-dibenzenacyclononaphane-5-carboxylic acid

 Chemical & Physical Properties

Molecular Formula C49H58N6O12
Molecular Weight 923.01800
Exact Mass 922.41100
PSA 222.45000
LogP 4.83790

 Synthetic Route

2,6-dibromo-N-methyltyrosine methyl ester structure

2,6-dibromo-N-m...

CAS#:108969-87-5

~%

(5S,8S)-36-methoxy-8-((5R,8S,11S,14S)-11-(4-methoxybenzyl)-N,5,8,10,14-pentamethyl-3,6,9,12-tetraoxo-1-phenyl-2-oxa-4,7,10,13-tetraazapentadecan-15-amido)-6-methyl-7-oxo-2-oxa-6-aza-1(1,4),3(1,3)-dibenzenacyclononaphane-5-carboxylic acid Structure

(5S,8S)-36-meth...

CAS#:115441-70-8

Literature: Inoue; Inaba; Umezawa; Yuasa; Itokawa; Ogura; Komatsu; Hara; Hoshino Chemical and Pharmaceutical Bulletin, 1995 ,  vol. 43,  # 8  p. 1325 - 1335
N-benzyloxycarbonyl-2,6-dichloro-N-methyltyrosine structure

N-benzyloxycarb...

CAS#:108969-88-6

~%

(5S,8S)-36-methoxy-8-((5R,8S,11S,14S)-11-(4-methoxybenzyl)-N,5,8,10,14-pentamethyl-3,6,9,12-tetraoxo-1-phenyl-2-oxa-4,7,10,13-tetraazapentadecan-15-amido)-6-methyl-7-oxo-2-oxa-6-aza-1(1,4),3(1,3)-dibenzenacyclononaphane-5-carboxylic acid Structure

(5S,8S)-36-meth...

CAS#:115441-70-8

Literature: Inoue; Inaba; Umezawa; Yuasa; Itokawa; Ogura; Komatsu; Hara; Hoshino Chemical and Pharmaceutical Bulletin, 1995 ,  vol. 43,  # 8  p. 1325 - 1335
methyl (5S,8S)-8-(((benzyloxy)carbonyl)(methyl)amino)-35-bromo-12,16-dichloro-36-hydroxy-6-methyl-7-oxo-2-oxa-6-aza-1(1,4),3(1,3)-dibenzenacyclononaphane-5-carboxylate structure

methyl (5S,8S)-...

CAS#:108969-74-0

~%

(5S,8S)-36-methoxy-8-((5R,8S,11S,14S)-11-(4-methoxybenzyl)-N,5,8,10,14-pentamethyl-3,6,9,12-tetraoxo-1-phenyl-2-oxa-4,7,10,13-tetraazapentadecan-15-amido)-6-methyl-7-oxo-2-oxa-6-aza-1(1,4),3(1,3)-dibenzenacyclononaphane-5-carboxylic acid Structure

(5S,8S)-36-meth...

CAS#:115441-70-8

Literature: Inoue; Inaba; Umezawa; Yuasa; Itokawa; Ogura; Komatsu; Hara; Hoshino Chemical and Pharmaceutical Bulletin, 1995 ,  vol. 43,  # 8  p. 1325 - 1335
methyl (5S,8S)-8-(((benzyloxy)carbonyl)(methyl)amino)-35-bromo-12,16-dichloro-36-methoxy-6-methyl-7-oxo-2-oxa-6-aza-1(1,4),3(1,3)-dibenzenacyclononaphane-5-carboxylate structure

methyl (5S,8S)-...

CAS#:108969-75-1

~%

(5S,8S)-36-methoxy-8-((5R,8S,11S,14S)-11-(4-methoxybenzyl)-N,5,8,10,14-pentamethyl-3,6,9,12-tetraoxo-1-phenyl-2-oxa-4,7,10,13-tetraazapentadecan-15-amido)-6-methyl-7-oxo-2-oxa-6-aza-1(1,4),3(1,3)-dibenzenacyclononaphane-5-carboxylic acid Structure

(5S,8S)-36-meth...

CAS#:115441-70-8

Literature: Inoue; Inaba; Umezawa; Yuasa; Itokawa; Ogura; Komatsu; Hara; Hoshino Chemical and Pharmaceutical Bulletin, 1995 ,  vol. 43,  # 8  p. 1325 - 1335
structure

CAS#:108969-80-8

~%

(5S,8S)-36-methoxy-8-((5R,8S,11S,14S)-11-(4-methoxybenzyl)-N,5,8,10,14-pentamethyl-3,6,9,12-tetraoxo-1-phenyl-2-oxa-4,7,10,13-tetraazapentadecan-15-amido)-6-methyl-7-oxo-2-oxa-6-aza-1(1,4),3(1,3)-dibenzenacyclononaphane-5-carboxylic acid Structure

(5S,8S)-36-meth...

CAS#:115441-70-8

Literature: Inoue; Inaba; Umezawa; Yuasa; Itokawa; Ogura; Komatsu; Hara; Hoshino Chemical and Pharmaceutical Bulletin, 1995 ,  vol. 43,  # 8  p. 1325 - 1335
methyl (5S,8S)-36-methoxy-8-((5R,8S,11S,14S)-11-(4-methoxybenzyl)-N,5,8,10,14-pentamethyl-3,6,9,12-tetraoxo-1-phenyl-2-oxa-4,7,10,13-tetraazapentadecan-15-amido)-6-methyl-7-oxo-2-oxa-6-aza-1(1,4),3(1,3)-dibenzenacyclononaphane-5-carboxylate structure

methyl (5S,8S)-...

CAS#:108969-73-9

~26%

(5S,8S)-36-methoxy-8-((5R,8S,11S,14S)-11-(4-methoxybenzyl)-N,5,8,10,14-pentamethyl-3,6,9,12-tetraoxo-1-phenyl-2-oxa-4,7,10,13-tetraazapentadecan-15-amido)-6-methyl-7-oxo-2-oxa-6-aza-1(1,4),3(1,3)-dibenzenacyclononaphane-5-carboxylic acid Structure

(5S,8S)-36-meth...

CAS#:115441-70-8

Literature: Inoue; Inaba; Umezawa; Yuasa; Itokawa; Ogura; Komatsu; Hara; Hoshino Chemical and Pharmaceutical Bulletin, 1995 ,  vol. 43,  # 8  p. 1325 - 1335
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Chemsrc provides CAS#:115441-70-8 MSDS, density, melting point, boiling point, structure, etc. Its name is (5S,8S)-36-methoxy-8-((5R,8S,11S,14S)-11-(4-methoxybenzyl)-N,5,8,10,14-pentamethyl-3,6,9,12-tetraoxo-1-phenyl-2-oxa-4,7,10,13-tetraazapentadecan-15-amido)-6-methyl-7-oxo-2-oxa-6-aza-1(1,4),3(1,3)-dibenzenacyclononaphane-5-carboxylic acid>> amp version: (5S,8S)-36-methoxy-8-((5R,8S,11S,14S)-11-(4-methoxybenzyl)-N,5,8,10,14-pentamethyl-3,6,9,12-tetraoxo-1-phenyl-2-oxa-4,7,10,13-tetraazapentadecan-15-amido)-6-methyl-7-oxo-2-oxa-6-aza-1(1,4),3(1,3)-dibenzenacyclononaphane-5-carboxylic acid

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