Chemical Compound

Himastatin

CAS Registry Number 126775-74-4
Himastatin chemical structure
Primary Record

Himastatin

In stock
694 g
Purity
98.1 %
CAS
126775-74-4

Compound Identifiers & Properties

CAS
126775-74-4
PubChem CID
9855348
SMILES
C[C@@H]([C@@H]1C(=O)N2[C@@H](C[C@@]3([C@H]2NC4=C3C=C(C=C4)C5=CC6=C(C=C5)N[C@@H]7[C@]6(C[C@@H]8N7C(=O)[C@H](NC(=O)[C@@H](NC(=O)[C@H]9C[C@H](CNN9C(=O)[C@@H](OC(=O)[C@H](NC8=O)C(C)C)C(C)C)O)CC(C)C)[C@H](C)O)O)O)C(=O)N[C@@H](C(=O)O[C@H](C(=O)N2[C@H](C[C@H](CN2)O)C(=O)N[C@H](C(=O)N1)CC(C)C)C(C)C)C(C)C)O
Canonical SMILES
CC(C)C[C@@H]1NC(=O)[C@H]2C[C@@H](O)CNN2C(=O)[C@H](C(C)C)OC(=O)[C@@H](C(C)C)NC(=O)[C@@H]2C[C@@]3(O)c4cc(-c5ccc6c(c5)[C@]5(O)C[C@H]7C(=O)N[C@H](C(C)C)C(=O)O[C@@H](C(C)C)C(=O)N8NC[C@H](O)C[C@@H]8C(=O)N[C@@H](CC(C)C)C(=O)N[C@H]([C@H](C)O)C(=O)N7[C@@H]5N6)ccc4N[C@H]3N2C(=O)[C@@H]([C@H](C)O)NC1=O

Names & Synonyms

  • Himastatin
  • RefChem:922961
  • orb1981804
  • SCHEMBL29711050
  • CHEBI:190009
  • BBF-00963
  • C72H104N14O20
  • CID9855348
  • HY-N144684
  • CID 9855348
  • CS-0433922
  • J1.052.774K
  • 126775-74-4
  • (1S,4R,7S,12R,14R,17S,20R,23S,31R)-28-[(1S,4R,7S,12R,14R,17S,20R,23S,31R)-12,31-dihydroxy-20-[(1S)-1-hydroxyethyl]-17-(2-methylpropyl)-2,5,8,15,18,21-hexaoxo-4,7-di(propan-2-yl)-6-oxa-3,9,10,16,19,22,24-heptazapentacyclo[20.10.0.09,14.023,31.025,30]dotriaconta-25(30),26,28-trien-28-yl]-12,31-dihydroxy-20-[(1S)-1-hydroxyethyl]-17-(2-methylpropyl)-4,7-di(propan-2-yl)-6-oxa-3,9,10,16,19,22,24-heptazapentacyclo[20.10.0.09,14.023,31.025,30]dotriaconta-25(30),26,28-triene-2,5,8,15,18,21-hexone
  • (1S,4R,7S,12R,14R,17S,20R,23S,31R)-28-((1S,4R,7S,12R,14R,17S,20R,23S,31R)-12,31-dihydroxy-20-((1S)-1-hydroxyethyl)-17-(2-methylpropyl)-2,5,8,15,18,21-hexaoxo-4,7-di(propan-2-yl)-6-oxa-3,9,10,16,19,22,24-heptazapentacyclo(20.10.0.09,14.023,31.025,30)dotriaconta-25(30),26,28-trien-28-yl)-12,31-dihydroxy-20-((1S)-1-hydroxyethyl)-17-(2-methylpropyl)-4,7-di(propan-2-yl)-6-oxa-3,9,10,16,19,22,24-heptazapentacyclo(20.10.0.09,14.023,31.025,30)dotriaconta-25(30),26,28-triene-2,5,8,15,18,21-hexone
  • (1S,4R,7S,12R,14R,17S,20R,23S,31R)-28-[(1S,4R,7S,12R,14R,17S,20R,23S,31R)-12,31-dihydroxy-20-[(1S)-1-hydroxyethyl]-17-(2-methylpropyl)-2,5,8,15,18,21-hexaoxo-4,7-bis(propan-2-yl)-6-oxa-3,9,10,16,19,22,24-heptaazapentacyclo[20.10.0.09,14.023,31.025,30]dotriaconta-25,27,29-trien-28-yl]-12,31-dihydroxy-20-[(1S)-1-hydroxyethyl]-17-(2-methylpropyl)-4,7-bis(propan-2-yl)-6-oxa-3,9,10,16,19,22,24-heptaazapentacyclo[20.10.0.09,14.023,31.025,30]dotriaconta-25,27,29-triene-2,5,8,15,18,21-hexone
  • (2R,2 R,4S,4 S,7R,7 R,10S,10 S,15R,15 R,17R,17 R,20S,20 S,23R,23 R,26S,26 S)-2beta,2 beta,15alpha,15 alpha-Tetrahydroxy-7alpha,7 alpha,10beta,10 beta-tetraisopropyl-20beta,20 beta-bis(2-methylpropyl)-23alpha,23 alpha-bis[(1S)-1-hydroxyethyl]-31,31 -bi[6,12,13,19,22,25,27-heptaaza-9-oxapentacyclo[26.4.0.02,26.04,25.012,17]dotriacontane-1(28),29,31-triene]-5,5 ,8,8 ,11,11 ,18,18 ,21,21 ,24,24 -dodecone