Chem
J-GLOBAL ID：200907091076272129   Nikkaji number：J91.862H

Bassianolide

バシアノリド
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： C48H84N4O12
Molecular formula furigana： C48-H84-N4-O12
Molecular weight： 909.216
InChI： InChI=1S/C48H84N4O12/c1-25(2)21-33-45(57)61-38(30(11)12)42(54)50(18)35(23-27(5)6)47(59)63-40(32(15)16)44(56)52(20)36(24-28(7)8)48(60)64-39(31(13)14)43(55)51(19)34(22-26(3)4)46(58)62-37(29(9)10)41(53)49(33)17/h25-40H,21-24H2,1-20H3/t33-,34-,35-,36-,37+,38+,39+,40+/m0/s1
InChI key： QVZZPLDJERFENQ-NKTUOASPSA-N
SMILES： CC(C)C[C@@H]1N(C)C(=O)[C@H](OC(=O)[C@H](CC(C)C)N(C)C(=O)[C@H](OC(=O)[C@H](CC(C)C)N(C)C(=O)[C@H](OC(=O)[C@H](CC(C)C)N(C)C(=O)[C@H](OC1=O)C(C)C)C(C)C)C(C)C)C(C)C
Systematic name  (3)：
  • シクロ[D-Hmb-N-メチル-L-Leu-D-Hmb-N-メチル-L-Leu-D-Hmb-N-メチル-L-Leu-D-Hmb-N-メチル-L-Leu-]
  • (3S,6R,9S,12R,15S,18R,21S,24R)-4,10,16,22-テトラメチル-3,9,15,21-テトラキス(2-メチルプロピル)-6,12,18,24-テトラキス(プロパン-2-イル)-1,7,13,19-テトラオキサ-4,10,16,22-テトラアザシクロテトラコサン-2,5,8,11,14,17,20,23-オクタオン
  • (3S,6R,9S,12R,15S,18R,21S,24R)-4,10,16,22-tetramethyl-3,9,15,21-tetrakis(2-methylpropyl)-6,12,18,24-tetrakis(propan-2-yl)-1,7,13,19-tetraoxa-4,10,16,22-tetraazacyclotetracosan-2,5,8,11,14,17,20,23-octone
Other name (3)：
  • Bassianolide
  • バシアノリド
  • Cyclo[D-Hmb-N-methyl-L-Leu-D-Hmb-N-methyl-L-Leu-D-Hmb-N-methyl-L-Leu-D-Hmb-N-methyl-L-Leu-]
CAS registry number： 64763-82-2
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