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Chemistry

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Also known as: Tripeptide, Bdbm81342, Q27467107
Molecular Formula
C24H35N7O8
Molecular Weight
549.6  g/mol
InChI Key
UFMHANUUWPWJKF-BZSNNMDCSA-N

Tripeptide
1 2D Structure

Tripeptide

2 Identification
2.1 Computed Descriptors
2.1.1 IUPAC Name
(2S)-2-[[(2S)-2-[[(2S)-2-acetamido-5-[[amino-(methylcarbamoylamino)methylidene]amino]pentanoyl]-methylamino]-3-phenylpropanoyl]amino]butanedioic acid
2.1.2 InChI
InChI=1S/C24H35N7O8/c1-14(32)28-16(10-7-11-27-23(25)30-24(39)26-2)21(36)31(3)18(12-15-8-5-4-6-9-15)20(35)29-17(22(37)38)13-19(33)34/h4-6,8-9,16-18H,7,10-13H2,1-3H3,(H,28,32)(H,29,35)(H,33,34)(H,37,38)(H4,25,26,27,30,39)/t16-,17-,18-/m0/s1
2.1.3 InChI Key
UFMHANUUWPWJKF-BZSNNMDCSA-N
2.1.4 Canonical SMILES
CC(=O)NC(CCCN=C(N)NC(=O)NC)C(=O)N(C)C(CC1=CC=CC=C1)C(=O)NC(CC(=O)O)C(=O)O
2.1.5 Isomeric SMILES
CC(=O)N[C@@H](CCCN=C(N)NC(=O)NC)C(=O)N(C)[C@@H](CC1=CC=CC=C1)C(=O)N[C@@H](CC(=O)O)C(=O)O
2.2 Synonyms
2.2.1 Depositor-Supplied Synonyms

1. Tripeptide

2. Bdbm81342

3. Q27467107

2.3 Create Date
2008-03-26
3 Chemical and Physical Properties
Molecular Weight 549.6 g/mol
Molecular Formula C24H35N7O8
XLogP3-0.7
Hydrogen Bond Donor Count7
Hydrogen Bond Acceptor Count9
Rotatable Bond Count15
Exact Mass549.25471110 g/mol
Monoisotopic Mass549.25471110 g/mol
Topological Polar Surface Area233 Ų
Heavy Atom Count39
Formal Charge0
Complexity920
Isotope Atom Count0
Defined Atom Stereocenter Count3
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently Bonded Unit Count1

API Reference Price

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[{"dataSource":"API Import","activeIngredients":"","year":"2023","qtr":"Q2","strtotime":1686940200,"product":"SPECPED GCU11P (COPPER TRIPEPTIDE-1(GHK-CU))","address":"208, 2ND FLOOR, MARATHON MAX, LINK ROAD,MULUND , WEST,","city":"MUMBAI,MAHARASHTRA","supplier":"SPEC CHEM INDUSTRY INC","supplierCountry":"CHINA","foreign_port":"NA","customer":"AMVIGOR ORGANICS PRIVATE LIMITED","customerCountry":"INDIA","quantity":"0.10","actualQuantity":"0.1","unit":"KGS","unitRateFc":"1000","totalValueFC":"114.8","currency":"USD","unitRateINR":"94355.6","date":"17-Jun-2023","totalValueINR":"9435.391","totalValueInUsd":"114.8","indian_port":"BOMBAY AIR","hs_no":"29362700","bill_no":"0","productDescription":"API","marketType":"REGULATED MARKET","country":"CHINA","selfForZScoreResived":"Pharma Grade","supplierPort":"NA","supplierAddress":"","customerAddress":"208, 2ND FLOOR, MARATHON MAX, LINK ROAD,MULUND , WEST,"},{"dataSource":"API Import","activeIngredients":"","year":"2023","qtr":"Q3","strtotime":1692815400,"product":"CS-O-45006: BIOTINYL-TRIPEPTIDE BIOTINYL-GHK CAS NO:299157-54-3 LAB CHEMICALS RESEARCH PURPOSE","address":"17 LOTUS BUSINESS PARK,NEW LINK RD ANDHERI W","city":"MUMBAI","supplier":"RS SYNTHESIS LLC","supplierCountry":"UNITED STATES","foreign_port":"NA","customer":"CLEARSYNTH LABS LIMITED","customerCountry":"INDIA","quantity":"0.00","actualQuantity":"1","unit":"GMS","unitRateFc":"225","totalValueFC":"384.4","currency":"USD","unitRateINR":"31637.1","date":"24-Aug-2023","totalValueINR":"31956.671","totalValueInUsd":"384.4","indian_port":"SAHAR AIR","hs_no":"29339990","bill_no":"0","productDescription":"API","marketType":"REGULATED MARKET","country":"UNITED STATES","selfForZScoreResived":"Pharma Grade","supplierPort":"NA","supplierAddress":"","customerAddress":"17 LOTUS BUSINESS PARK,NEW LINK RD ANDHERI W"},{"dataSource":"API Import","activeIngredients":"","year":"2023","qtr":"Q4","strtotime":1699468200,"product":"COPPER TRIPEPTIDE-1","address":"C-10 KRISHANA REGENCY, OFF.S.V.RD.","city":"DER NAGAR,MALAD[W],MUMBAI","supplier":"WELLPEP CO.LTD.","supplierCountry":"KOREA, REPUBLIC OF","foreign_port":"BATUMI","customer":"SYNERCARE","customerCountry":"INDIA","quantity":"0.05","actualQuantity":"50","unit":"GMS","unitRateFc":"30","totalValueFC":"1566.9","currency":"USD","unitRateINR":"2602.4","date":"09-Nov-2023","totalValueINR":"130117.53","totalValueInUsd":"1566.9","indian_port":"Bombay Air","hs_no":"29332990","bill_no":"8697435","productDescription":"API","marketType":"REGULATED MARKET","country":"KOREA,REPUBLIC OF","selfForZScoreResived":"Pharma Grade","supplierPort":"BATUMI","supplierAddress":"RM 310 INSTA1 204 CONVENSIA DAERO YEONSU-GU INCHEON KOREASDNF Korea, Republic of","customerAddress":"C-10 KRISHANA REGENCY, OFF.S.V.RD."},{"dataSource":"API Import","activeIngredients":"","year":"2024","qtr":"Q1","strtotime":1705689000,"product":"COPPER TRIPEPTIDE-1","address":"C-10 KRISHANA REGENCY, OFF.S.V.RD.","city":"DER NAGAR,MALAD[W],MUMBAI","supplier":"WELLPEP CO., LTD","supplierCountry":"KOREA, REPUBLIC OF","foreign_port":"BATUMI","customer":"SYNERCARE","customerCountry":"INDIA","quantity":"0.05","actualQuantity":"50","unit":"GMS","unitRateFc":"30.2","totalValueFC":"1572.4","currency":"USD","unitRateINR":"2611.5","date":"20-Jan-2024","totalValueINR":"130572.85","totalValueInUsd":"1572.4","indian_port":"Bombay Air","hs_no":"29332990","bill_no":"9748659","productDescription":"API","marketType":"REGULATED MARKET","country":"KOREA,REPUBLIC OF","selfForZScoreResived":"Pharma Grade","supplierPort":"BATUMI","supplierAddress":"RM 310, INSTA1, 204 CONVENSIA-DAERO, YEONSU-GU, INCHEON,SDNF Korea, Republic of","customerAddress":"C-10 KRISHANA REGENCY, OFF.S.V.RD."},{"dataSource":"API Import","activeIngredients":"","year":"2024","qtr":"Q2","strtotime":1718994600,"product":"COPPER TRIPEPTIDE-1","address":"N\/A","city":"","supplier":"PACIFIC SPOT LIMITED","supplierCountry":"CHINA","foreign_port":"HONG KONG","customer":"FLYCHEM INDIA PRIVATE LIMITED","customerCountry":"INDIA","quantity":"1.00","actualQuantity":"1000","unit":"GMS","unitRateFc":"2.6","totalValueFC":"2639.4","currency":"USD","unitRateINR":"219.2","date":"22-Jun-2024","totalValueINR":"219180","totalValueInUsd":"2639.4","indian_port":"Hyderabad Air","hs_no":"29332990","bill_no":"4138055","productDescription":"API","marketType":"REGULATED MARKET","country":"CHINA","selfForZScoreResived":"Pharma Grade","supplierPort":"HONG KONG","supplierAddress":"UNITS A-C,25\/F, SEABRIGHT PLAZANO,9-23 SHELL STREET,NORTH POINTHONGKONG HK","customerAddress":"N\/A"}]
17-Jun-2023
22-Jun-2024
KGS
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