Chem
J-GLOBAL ID：200907024261638890   Nikkaji number：J1.789.194D

Leucamide A

ロイカミドA
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： C29H37N7O6S
Molecular formula furigana： C29-H37-N7-O6-S
Molecular weight： 611.720
InChI： InChI=1S/C29H37N7O6S/c1-13(2)10-17-29(40)36-9-7-8-20(36)24(38)34-21(14(3)4)28-33-19(12-43-28)27-35-22(16(6)42-27)25(39)30-15(5)26-32-18(11-41-26)23(37)31-17/h11-15,17,20-21H,7-10H2,1-6H3,(H,30,39)(H,31,37)(H,34,38)/t15-,17-,20-,21-/m0/s1
InChI key： LTRLGDUGAPGZOA-OQRYQMPQSA-N
SMILES： CC(C)C[C@@H]1NC(=O)c2coc(n2)[C@H](C)NC(=O)c2nc(oc2C)c2csc(n2)[C@@H](NC(=O)[C@@H]2CCCN2C1=O)C(C)C
Systematic name  (3)：
  • (8S,15S,21S,24S)-4,8-ジメチル-15-イソブチル-24-イソプロピル-3,10-ジオキサ-26-チア-7,14,17,23,28,29,30-ヘプタアザペンタシクロ[23.2.1.12,5.19,12.017,21]トリアコンタン-1(27),2(30),4,9(29),11,25(28)-ヘキサエン-6,13,16,22-テトラオン
  • (8S,15S,21S,24S)-4,8-ジメチル-15-(2-メチルプロピル)-24-(プロパン-2-イル)-3,10-ジオキサ-26-チア-7,14,17,23,28,29,30-ヘプタアザペンタシクロ[23.2.1.12,5.19,12.017,21]トリアコンタ-1(27),2(30),4,9(29),11,25(28)-ヘキサエン-6,13,16,22-テトラオン
  • (8S,15S,21S,24S)-4,8-dimethyl-15-(2-methylpropyl)-24-(propan-2-yl)-3,10-dioxa-26-thia-7,14,17,23,28,29,30-heptaazapentacyclo[23.2.1.12,5.19,12.017,21]triaconta-1(27),2(30),4,9(29),11,25(28)-hexaene-6,13,16,22-tetrone
Other name (3)：
  • (8S,15S,21S,24S)-4,8-Dimethyl-15-isobutyl-24-isopropyl-3,10-dioxa-26-thia-7,14,17,23,28,29,30-heptaazapentacyclo[23.2.1.12,5.19,12.017,21]triacontane-1(27),2(30),4,9(29),11,25(28)-hexene-6,13,16,22-tetrone
  • ロイカミドA
  • Leucamide A
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