Chem
J-GLOBAL ID：200907002707955930   Nikkaji number：J492.625K

Phallisin

ファリシン
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： C35H48N8O12S
Molecular formula furigana： C35-H48-N8-O12-S
Molecular weight： 804.870
InChI： InChI=1S/C35H48N8O12S/c1-15-27(48)38-22-9-20-19-6-4-5-7-21(19)41-33(20)56-12-24(34(54)43-11-18(47)8-25(43)31(52)37-15)40-32(53)26(17(3)46)42-28(49)16(2)36-30(51)23(39-29(22)50)10-35(55,13-44)14-45/h4-7,15-18,22-26,41,44-47,55H,8-14H2,1-3H3,(H,36,51)(H,37,52)(H,38,48)(H,39,50)(H,40,53)(H,42,49)/t15-,16-,17-,18-,22-,23-,24-,25-,26+/m0/s1
InChI key： SRDQDZSLNAKOIT-KNFLFUGLSA-N
SMILES： C[C@H](O)[C@H]1NC(=O)[C@H](C)NC(=O)[C@H](CC(O)(CO)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-4-(ヒドロキシメチル)-L-Nva-]
  • (1S,14R,18S,20S,23S,28S,31S,34R)-28-[2,3-ジヒドロキシ-2-(ヒドロキシメチル)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-(hydroxymethyl)propyl]-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)：
  • ファリシン
  • Phallisin
  • Cyclo[L-Ala-D-Thr-L-Cys(1)-L-c4Hyp-L-Ala-L-Trp2(1)-4,5-dihydroxy-4-(hydroxymethyl)-L-Nva-]
CAS registry number： 19774-69-7
Thsaurus map：
Thesaurus Map

Return to Previous Page

TOP

BOTTOM