Chem
J-GLOBAL ID：200907028445789730   Nikkaji number：J972E

Cytochalasin B

サイトカラシンB
Substance type：
Substance type
Substance type classified into 3 categories.
Decided structure: Substances with a clear structure
Undicided Structure: Substances with unknown or undetermined structure
Mixtures: Mixtures, racemic compounds, or compounds with relative structural arrangements
Decided structure
Molecular formula： C29H37NO5
Molecular formula furigana： C29-H37-N-O5
Molecular weight： 479.617
InChI： InChI=1S/C29H37NO5/c1-18-9-7-13-22(31)15-16-25(32)35-29-23(14-8-10-18)27(33)20(3)19(2)26(29)24(30-28(29)34)17-21-11-5-4-6-12-21/h4-6,8,11-12,14-16,18-19,22-24,26-27,31,33H,3,7,9-10,13,17H2,1-2H3,(H,30,34)/b14-8+,16-15+/t18-,19-,22-,23+,24+,26+,27-,29-/m1/s1
InChI key： GBOGMAARMMDZGR-TYHYBEHESA-N
SMILES： C[C@H]1[C@H]2[C@H](Cc3ccccc3)NC(=O)[C@@]32OC(=O)/C=C/[C@H](O)CCC[C@@H](C)C/C=C/[C@H]3[C@H](O)C1=C
Systematic name  (3)：
  • (7S,13E,16R,20R,21E)-7,20-ジヒドロキシ-16-メチル-10-フェニル-24-オキサ[14]サイトカラサ-6(12),13,21-トリエン-1,23-ジオン
  • (5R,9R,12aS,13S,15S,15aS,16S,18aS)-16-ベンジル-5,13-ジヒドロキシ-9,15-ジメチル-14-メチリデン-2H,5H,6H,7H,8H,9H,10H,12aH,13H,14H,15H,15aH,16H,17H,18H-オキサシクロテトラデカ[3,2-e]イソインドール-2,18-ジオン
  • (5R,9R,12aS,13S,15S,15aS,16S,18aS)-16-benzyl-5,13-dihydroxy-9,15-dimethyl-14-methylidene-2H,5H,6H,7H,8H,9H,10H,12aH,13H,14H,15H,15aH,16H,17H,18H-oxacyclotetradeca[3,2-e]isoindole-2,18-dione
Other name (6)：
  • シトカラシンB
  • サイトカラシンB
  • Cytochalasin B
  • (7S,13E,16R,20R,21E)-7,20-Dihydroxy-16-methyl-10-phenyl-24-oxa[14]cytochalasa-6(12),13,21-triene-1,23-dione
  • Phomin
Show all
CAS registry number： 14930-96-2
Regulation number (2)：
  • RO0205000
  • EINECS2390002
Application (1)：
macrolide antibiotics
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