Chem
J-GLOBAL ID：200907073497192231   Nikkaji number：J152.082B

Phalloidine

ファロイジン
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： C35H48N8O11S
Molecular formula furigana： C35-H48-N8-O11-S
Molecular weight： 788.870
InChI： InChI=1S/C35H48N8O11S/c1-15-27(47)38-22-10-20-19-7-5-6-8-21(19)41-33(20)55-13-24(34(53)43-12-18(46)9-25(43)31(51)37-15)40-32(52)26(17(3)45)42-28(48)16(2)36-30(50)23(39-29(22)49)11-35(4,54)14-44/h5-8,15-18,22-26,41,44-46,54H,9-14H2,1-4H3,(H,36,50)(H,37,51)(H,38,47)(H,39,49)(H,40,52)(H,42,48)/t15-,16-,17-,18-,22-,23-,24-,25-,26+,35?/m0/s1
InChI key： KPKZJLCSROULON-HPGKBWJOSA-N
SMILES： C[C@H](O)[C@H]1NC(=O)[C@H](C)NC(=O)[C@H](CC(C)(O)CO)NC(=O)[C@@H]2Cc3c(SC[C@H](NC1=O)C(=O)N1C[C@@H](O)C[C@H]1C(=O)N[C@@H](C)C(=O)N2)[nH]c1ccccc31
Systematic name  (3)：
  • シクロ(L-Ala-D-Thr-L-Cys(1)-L-c4Hyp-L-Ala-L-Trp2(1)-4,5′-ジヒドロキシ-L-Leu-)
  • (1S,14R,18S,20S,23S,28S,31S,34R)-28-(2,3-ジヒドロキシ-2-メチルプロピル)-18-ヒドロキシ-34-[(1S)-1-ヒドロキシエチル]-23,31-ジメチル-12-チア-10,16,22,25,27,30,33,36-オクタアザペンタシクロ[12.11.11.03,11.04,9.016,20]ヘキサトリアコンタ-3(11),4,6,8-テトラエン-15,21,24,26,29,32,35-ヘプタオン
  • (1S,14R,18S,20S,23S,28S,31S,34R)-28-(2,3-dihydroxy-2-methylpropyl)-18-hydroxy-34-[(1S)-1-hydroxyethyl]-23,31-dimethyl-12-thia-10,16,22,25,27,30,33,36-octaazapentacyclo[12.11.11.03,11.04,9.016,20]hexatriaconta-3(11),4,6,8-tetraene-15,21,24,26,29,32,35-heptone
Other name (3)：
  • ファロイジン
  • Phalloidin
  • Cyclo(L-Ala-D-Thr-L-Cys(1)-L-c4Hyp-L-Ala-L-Trp2(1)-4,5′-dihydroxy-L-Leu-)
CAS registry number： 17466-45-4
Regulation number (1)：
  • EINECS2414845
KEGG COMPOUND： C08439
Application (1)：
mycotoxin
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