Chemical Compound

(3S)-3-{[(3S,6S,9R,15S,18R,21S,24S,30S,31R)-3-[2-(2-AMINOPHENYL)-2-OXOETHYL]-24-(3-AMINOPROPYL)-15,21-BIS(CARBOXYMETHYL)-6-[(2R)-1-CARBOXYPROPAN-2-YL]-9-(HYDROXYMETHYL)-18,31-DIMETHYL-2,5,8,11,14,17,20,23,26,29-DECAOXO-1-OXA-4,7,10,13,16,19,22,25,28-NONAAZACYCLOHENTRIACONTAN-30-YL]CARBAMOYL}-3-[(2S)-3-CARBAMOYL-2-[(2S)-2-DECANAMIDO-3-(1H-INDOL-3-YL)PROPANAMIDO]PROPANAMIDO]PROPANOIC ACID

CAS Registry Number 103060-53-3
返回搜索 申请报价
(3S)-3-{[(3S,6S,9R,15S,18R,21S,24S,30S,31R)-3-[2-(2-AMINOPHENYL)-2-OXOETHYL]-24-(3-AMINOPROPYL)-15,21-BIS(CARBOXYMETHYL)-6-[(2R)-1-CARBOXYPROPAN-2-YL]-9-(HYDROXYMETHYL)-18,31-DIMETHYL-2,5,8,11,14,17,20,23,26,29-DECAOXO-1-OXA-4,7,10,13,16,19,22,25,28-NONAAZACYCLOHENTRIACONTAN-30-YL]CARBAMOYL}-3-[(2S)-3-CARBAMOYL-2-[(2S)-2-DECANAMIDO-3-(1H-INDOL-3-YL)PROPANAMIDO]PROPANAMIDO]PROPANOIC ACID 结构式
Primary record

(3S)-3-{[(3S,6S,9R,15S,18R,21S,24S,30S,31R)-3-[2-(2-AMINOPHENYL)-2-OXOETHYL]-24-(3-AMINOPROPYL)-15,21-BIS(CARBOXYMETHYL)-6-[(2R)-1-CARBOXYPROPAN-2-YL]-9-(HYDROXYMETHYL)-18,31-DIMETHYL-2,5,8,11,14,17,20,23,26,29-DECAOXO-1-OXA-4,7,10,13,16,19,22,25,28-NONAAZACYCLOHENTRIACONTAN-30-YL]CARBAMOYL}-3-[(2S)-3-CARBAMOYL-2-[(2S)-2-DECANAMIDO-3-(1H-INDOL-3-YL)PROPANAMIDO]PROPANAMIDO]PROPANOIC ACID

库存
1,477 克
纯度
98.1 %
CAS
103060-53-3

化合物标识与属性

CAS
103060-53-3
PubChem CID
163353950
SMILES
CCCCCCCCCC(=O)N[C@@H](CC1=CNC2=CC=CC=C21)C(=O)N[C@@H](CC(=O)N)C(=O)N[C@@H](CC(=O)O)C(=O)NC3C(OC(=O)[C@@H](NC(=O)C(NC(=O)[C@H](NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](NC(=O)C(NC(=O)[C@@H](NC(=O)CNC3=O)CCCN)CC(=O)O)C)CC(=O)O)CO)[C@H](C)CC(=O)O)CC(=O)C4=CC=CC=C4N)C
Canonical SMILES
CCCCCCCCCC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CC(=O)O)C(=O)NC1C(=O)NCC(=O)N[C@@H](CCCN)C(=O)NC(CC(=O)O)C(=O)N[C@H](C)C(=O)N[C@@H](CC(=O)O)C(=O)NCC(=O)N[C@H](CO)C(=O)NC([C@H](C)CC(=O)O)C(=O)N[C@@H](CC(=O)c2ccccc2N)C(=O)OC1C

名称与同义词

  • DAPTOMYCIN
  • EBC-457084
  • 103060-53-3
  • (3S)-3-[[(2S)-4-amino-2-[[(2S)-2-(decanoylamino)-3-(1H-indol-3-yl)propanoyl]amino]-4-oxobutanoyl]amino]-4-[[(3S,9R,15S,18R,24S)-3-[2-(2-aminophenyl)-2-oxoethyl]-24-(3-aminopropyl)-15,21-bis(carboxymethyl)-6-[(2R)-1-carboxypropan-2-yl]-9-(hydroxymethyl)-18,31-dimethyl-2,5,8,11,14,17,20,23,26,29-decaoxo-1-oxa-4,7,10,13,16,19,22,25,28-nonazacyclohentriacont-30-yl]amino]-4-oxobutanoic acid
  • (3S)-3-{[(3S,6S,9R,15S,18R,21S,24S,30S,31R)-3-[2-(2-AMINOPHENYL)-2-OXOETHYL]-24-(3-AMINOPROPYL)-15,21-BIS(CARBOXYMETHYL)-6-[(2R)-1-CARBOXYPROPAN-2-YL]-9-(HYDROXYMETHYL)-18,31-DIMETHYL-2,5,8,11,14,17,20,23,26,29-DECAOXO-1-OXA-4,7,10,13,16,19,22,25,28-NONAAZACYCLOHENTRIACONTAN-30-YL]CARBAMOYL}-3-[(2S)-3-CARBAMOYL-2-[(2S)-2-DECANAMIDO-3-(1H-INDOL-3-YL)PROPANAMIDO]PROPANAMIDO]PROPANOIC ACID
  • decanoyl-Trp-Asn-Asp-DL-xiThr(1)-Gly-Orn-DL-Asp-D-Ala-Asp-Gly-D-Ser-DL-Glu(3R-Me)-Asp(Ph(2-NH2))-(1)
  • N-decanoyl-L-tryptophyl-Dasparaginyl-L-aspartyl-L-threonylglycyl-L-ornithyl-L-aspartyl-D-alanyl-L-aspartylglycyl-Dseryl-threo-3-methyl-L-glutamyl-3-anthraniloyl-L-alanine 1-lactone;N-decanoyl-L-tryptophyl-Dasparaginyl-L-aspartyl-L-threonylglycyl-L-ornithyl-L-aspartyl-D-alanyl-L-aspartylglycyl-Dseryl-threo-3-methyl-L-glutamyl-3-anthraniloyl-L-alanine 1-lactone