Chemical Compound

[29-(butan-2-yl)-21-(3,4-dihydroxybutan-2-yl)-2,14-dihydroxy-11-oxido-5,8,20,23,24,27,30,33-octaoxo-1,2,3,5,6,7,8,9,10,12,17,18,19,20,21,22,23,23a-octadecahydro-9,18-(epiminoethanoiminoethanoiminoethanoiminomethano)pyrrolo[1',2':8,9][1,5,8,11,14]thiatetraazacyclooctadecino[18,17-b]indol-6-yl]acetic acid

CAS Registry Number 21150-22-1
[29-(butan-2-yl)-21-(3,4-dihydroxybutan-2-yl)-2,14-dihydroxy-11-oxido-5,8,20,23,24,27,30,33-octaoxo-1,2,3,5,6,7,8,9,10,12,17,18,19,20,21,22,23,23a-octadecahydro-9,18-(epiminoethanoiminoethanoiminoethanoiminomethano)pyrrolo[1',2':8,9][1,5,8,11,14]thiatetraazacyclooctadecino[18,17-b]indol-6-yl]acetic acid 结构式
Primary record

[29-(butan-2-yl)-21-(3,4-dihydroxybutan-2-yl)-2,14-dihydroxy-11-oxido-5,8,20,23,24,27,30,33-octaoxo-1,2,3,5,6,7,8,9,10,12,17,18,19,20,21,22,23,23a-octadecahydro-9,18-(epiminoethanoiminoethanoiminoethanoiminomethano)pyrrolo[1',2':8,9][1,5,8,11,14]thiatetraazacyclooctadecino[18,17-b]indol-6-yl]acetic acid

库存
4,114 克
纯度
99.0 %
CAS
21150-22-1

化合物标识与属性

CAS
21150-22-1
PubChem CID
2276
SMILES
CCC(C)C1C(=O)NCC(=O)NC2CS(=O)C3=C(CC(C(=O)NCC(=O)N1)NC(=O)C(NC(=O)C4CC(CN4C(=O)C(NC2=O)CC(=O)O)O)C(C)C(CO)O)C5=C(N3)C=C(C=C5)O
Canonical SMILES
CCC(C)C1NC(=O)CNC(=O)C2Cc3c([nH]c4cc(O)ccc34)S(=O)CC(NC(=O)CNC1=O)C(=O)NC(CC(=O)O)C(=O)N1CC(O)CC1C(=O)NC(C(C)C(O)CO)C(=O)N2

名称与同义词

  • BETA-AMANITIN
  • beta-Amanitine
  • beta-Amatoxin
  • b-Amanitin
  • -Amanitin
  • beta -Amanitin
  • .beta.-Amanitin
  • |A-Amanitin
  • AC1L1DBI
  • AC1Q6LRA
  • 21150-22-1
  • SCHEMBL3505949
  • CHEMBL1978871
  • SCHEMBL29361208
  • CTK8G3957
  • HSDB 3459
  • CID2276
  • MSK7284
  • 1-L-Aspartic acid alpha-amanitin
  • C39H53N9O15S
  • IEQCUEXVAPAFMQ-UHFFFAOYSA-N
  • KST-1A2769
  • |A-Amanitin from Amanita phalloides
  • alpha-Amanitin, 1-l-aspartic acid-
  • EINECS 244-244-8
  • AR-1A8839
  • NSC627727
  • FA57612
  • NSC-627727
  • BRN 1071139
  • DA-51059
  • LS-80950
  • NCI60_008881
  • NS00122190
  • G91473
  • beta-Amanitin from Amanita phalloides, ~90% (HPLC)
  • 2-[34-butan-2-yl-13-(3,4-dihydroxybutan-2-yl)-8,22-dihydroxy-2,5,11,14,27,30,33,36,39-nonaoxo-27lambda4-thia-3,6,12,15,25,29,32,35,38-nonazapentacyclo[14.12.11.06,10.018,26.019,24]nonatriaconta-18(26),19(24),20,22-tetraen-4-yl]acetic acid
  • [29-(butan-2-yl)-21-(3,4-dihydroxybutan-2-yl)-2,14-dihydroxy-11-oxido-5,8,20,23,24,27,30,33-octaoxo-1,2,3,5,6,7,8,9,10,12,17,18,19,20,21,22,23,23a-octadecahydro-9,18-(epiminoethanoiminoethanoiminoethanoiminomethano)pyrrolo[1',2':8,9][1,5,8,11,14]thiatetraazacyclooctadecino[18,17-b]indol-6-yl]acetic acid
  • 21878-88-6
  • 2-[13-(2,3-dihydroxy-1-methyl-propyl)-8,22-dihydroxy-2,5,11,14,27,30,33,36,39-nonaoxo-34-sec-butyl-27lambda4-thia-3,6,12,15,25,29,32,35,38-nonazapentacyclo[14.12.11.06,10.018,26.019,24]nonatriaconta-18(26),19(24),20,22-tetraen-4-yl]acetic acid
  • 9,18-(Iminoethaniminoethaniminoethaniminomethano)pyrrolo(1',2':8,9)(1,5,8,11,14)thiatetraazacyclooctadecino(18,17-b)indole-6-acetic acid, 1,2,3,5,6,7,8,9,10,12,17,18,19,20,21,22,23,23a-octadecahydro-29-sec-butyl-2,14-dihydroxy-21-(2,3-dihydroxy-1-methylpropyl)-5,8,20,23,24,27,30,33-octaoxo-, 11-oxide