Chemical Compound

Pneumocandin B0, 1-[(4R,5S)-5-[(2-aminoethyl)amino]-N2-[(10R,12S)-10,12-dimethyl-1-oxotetradecyl]-4-hydroxy-L-ornithine]-5-[(3R)-3-hydroxy-L-ornithine]-, acetate (1:2); Pneumocandin B0, 1-[(4R,5S)-5-[(2-aminoethyl)amino]-N2-[(10R,12S)-10,12-dimethyl-1-oxotetradecyl]-4-hydroxy-L-ornithine]-5-(threo-3-hydroxy-L-ornithine)-, diacetate (salt); Pneumocandin B0, 1-[(4R,5S)-5-[(2-aminoethyl)amino]-N2-[(10R,12S)-10,12-dimethyl-1-oxotetradecyl]-4-hydroxy-L-ornithine]-5-[(3R)-3-hydroxy-L-ornithine]-, diacetate (salt) (9CI); Cancidas; Caspofungin acetate; Caspofungin diacetate; L 743872; L 743873; MK 0991

CAS Registry Number 179463-17-3
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Pneumocandin B0, 1-[(4R,5S)-5-[(2-aminoethyl)amino]-N2-[(10R,12S)-10,12-dimethyl-1-oxotetradecyl]-4-hydroxy-L-ornithine]-5-[(3R)-3-hydroxy-L-ornithine]-, acetate (1:2); Pneumocandin B0, 1-[(4R,5S)-5-[(2-aminoethyl)amino]-N2-[(10R,12S)-10,12-dimethyl-1-oxotetradecyl]-4-hydroxy-L-ornithine]-5-(threo-3-hydroxy-L-ornithine)-, diacetate (salt); Pneumocandin B0, 1-[(4R,5S)-5-[(2-aminoethyl)amino]-N2-[(10R,12S)-10,12-dimethyl-1-oxotetradecyl]-4-hydroxy-L-ornithine]-5-[(3R)-3-hydroxy-L-ornithine]-, diacetate (salt) (9CI); Cancidas; Caspofungin acetate; Caspofungin diacetate; L 743872; L 743873; MK 0991 结构式
Primary record

Pneumocandin B0, 1-[(4R,5S)-5-[(2-aminoethyl)amino]-N2-[(10R,12S)-10,12-dimethyl-1-oxotetradecyl]-4-hydroxy-L-ornithine]-5-[(3R)-3-hydroxy-L-ornithine]-, acetate (1:2); Pneumocandin B0, 1-[(4R,5S)-5-[(2-aminoethyl)amino]-N2-[(10R,12S)-10,12-dimethyl-1-oxotetradecyl]-4-hydroxy-L-ornithine]-5-(threo-3-hydroxy-L-ornithine)-, diacetate (salt); Pneumocandin B0, 1-[(4R,5S)-5-[(2-aminoethyl)amino]-N2-[(10R,12S)-10,12-dimethyl-1-oxotetradecyl]-4-hydroxy-L-ornithine]-5-[(3R)-3-hydroxy-L-ornithine]-, diacetate (salt) (9CI); Cancidas; Caspofungin acetate; Caspofungin diacetate; L 743872; L 743873; MK 0991

库存
3,120 克
纯度
98.6 %
CAS
179463-17-3

化合物标识与属性

CAS
179463-17-3
PubChem CID
6850808
SMILES
CCC(C)CC(C)CCCCCCCCC(=O)N[C@H]1C[C@H]([C@H](NC(=O)[C@@H]2[C@H](CCN2C(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H]3C[C@H](CN3C(=O)[C@@H](NC1=O)[C@@H](C)O)O)[C@@H]([C@H](C4=CC=C(C=C4)O)O)O)[C@@H](CCN)O)O)NCCN)O.CC(=O)O.CC(=O)O
Canonical SMILES
CC(=O)O.CC(=O)O.CCC(C)CC(C)CCCCCCCCC(=O)N[C@H]1C[C@@H](O)[C@@H](NCCN)NC(=O)[C@@H]2[C@@H](O)CCN2C(=O)[C@H]([C@H](O)CCN)NC(=O)[C@H]([C@H](O)[C@@H](O)c2ccc(O)cc2)NC(=O)[C@@H]2C[C@@H](O)CN2C(=O)[C@H]([C@@H](C)O)NC1=O

名称与同义词

  • Caspofungin acetate
  • Cancidas
  • caspofungin diacetate
  • Caspofungin
  • Cancidas (TN)
  • Caspofungin (Acetate)
  • 179463-17-3
  • Cancidas acetate salt
  • RefChem:56793
  • Caspofungin Acetate [USAN]
  • 1)-peptide diacetate salt
  • UNII-VUW370O5QE
  • VUW370O5QE
  • SCHEMBL149293
  • Caspofungin Acetate (>90%)
  • MFCD08141839
  • MK0991
  • OGUJBRYAAJYXQP-LLXMLGLCSA-N
  • Caspofungin acetate (JAN/USAN)
  • CHEBI:59900
  • DTXSID60904590
  • C56H96N10O19
  • DTXCID801333717
  • MK 0991
  • MK-0991
  • C52H88N10O15.2C2H4O2
  • Caspofungin acetate [USAN:BAN:JAN]
  • AKOS025401982
  • ACN-037197
  • BAT-010843
  • CID6850808
  • FC16269
  • Caspofungin acetate - Bio-X trade mark
  • AC-27763
  • BC164293
  • DA-62025
  • PD126809
  • LS-173700
  • FT-0664404
  • Y1176
  • D02501
  • F20901
  • L 743872
  • L-743872
  • MK-0991 (Acetate);L-743872 (Acetate)
  • W-5367
  • L 743,872
  • L-743,872
  • 463C173
  • A899454
  • C52-H88-N10-O15.2C2-H4-O2
  • L 743873
  • (4R,5S)-5-((2-Aminoethyl)amino)-N(sup 2)-(10,12-dimethyltetradecanoyl)-4-hydroxy-L-ornithyl-L-threonyl-trans-4-hydroxy-L-prolyl-(S)-4-hydroxy-4-(p-hydroxyphenyl)-L-threonyl-threo-3-hydroxy-L-ornithyl-trans-3-hydroxy-L-proline cyclic (6-1)-peptide, diacetate (salt)
  • 1-((4R,5S)-5-((2-Aminoethyl)amino)-N(sup 2)-(10,12-dimethyl-1-oxotetradecyl)-4-hydroxy-L-ornithine)-5-((3R)-3-hydroxy-L-ornithine)pneumocandin B0, diacetate (salt)
  • acetic acid;N-[(3S,6S,9S,11R,15S,18S,20R,21S,24S,25S)-21-(2-aminoethylamino)-3-[(1R)-3-amino-1-hydroxy-propyl]-6-[(1S,2S)-1,2-dihydroxy-2-(4-hydroxyphenyl)ethyl]-11,20,25-trihydroxy-15-[(1R)-1-hydroxyethyl]-2,5,8,14,17,23-hexaoxo-1,4,7,13,16,22-hexazatricyclo[22.3.0.09,13]heptacosan-18-yl]-10,12-dimethyl-tetradecanamide
  • Pneumocandin B0, 1-((4R,5S)-5-((2-aminoethyl)amino)-N2-(10,12-dimethyl-1-oxotetradecyl)-4-hydroxy-L-ornithine)-5-((3R)-3-hydroxy-L-ornithine)-, diacetate (salt)
  • Pneumocandin B0, 1-[(4R,5S)-5-[(2-aminoethyl)amino]-N2-[(10R,12S)-10,12-dimethyl-1-oxotetradecyl]-4-hydroxy-L-ornithine]-5-[(3R)-3-hydroxy-L-ornithine]-, acetate (1:2); Pneumocandin B0, 1-[(4R,5S)-5-[(2-aminoethyl)amino]-N2-[(10R,12S)-10,12-dimethyl-1-oxotetradecyl]-4-hydroxy-L-ornithine]-5-(threo-3-hydroxy-L-ornithine)-, diacetate (salt); Pneumocandin B0, 1-[(4R,5S)-5-[(2-aminoethyl)amino]-N2-[(10R,12S)-10,12-dimethyl-1-oxotetradecyl]-4-hydroxy-L-ornithine]-5-[(3R)-3-hydroxy-L-ornithine]-, diacetate (salt) (9CI); Cancidas; Caspofungin acetate; Caspofungin diacetate; L 743872; L 743873; MK 0991
  • Pneumocandin b0, 1-[(4r,5s)-5-[(2-aminoetil)amino]-n2-[(10r,12s)-10,12-dimetil-1-oxotetradecil]-4-hidroxi-l-ornitina]-5-[(3r)-3-hidroxi-l-ornitina]-, acetato (1:2)