138008-04-5 (赤芝孢子内酯A,16,23-Cyclolanost-8-en-26-oicacid, 7,12,23-trihydroxy-3,11,15-trioxo-, g-lactone, (7b,12b,16a,23b,25R)- (9CI))

CAS号:
138008-04-5
中文名称:
赤芝孢子内酯A
英文名称:
16,23-Cyclolanost-8-en-26-oicacid, 7,12,23-trihydroxy-3,11,15-trioxo-, g-lactone, (7b,12b,16a,23b,25R)- (9CI)
分子式:
C30H40O7
分子量:
512.63440990448

赤芝孢子内酯A(138008-04-5)名称与标识符

名称

中文别名:
赤芝孢子内酯A;
英文别名:
16,23-Cyclolanost-8-en-26-oicacid, 7,12,23-trihydroxy-3,11,15-trioxo-, g-lactone, (7b,12b,16a,23b,25R)- (9CI);(5xi,7alpha,12beta,16beta,17xi,23S,25R)-7,12,23-trihydroxy-26,29-epoxy-16,23-cyclolanost-8-ene-3,11,15,26-tetrone;16,23-Cyclolanost-8-en-26-oic acid, 7,12,23-trihydroxy-3,11,15-trioxo-, gamma-lactone, (7beta,12beta,16alpha,23beta,25R)-;Ganosporelactone A;16,23-Cyclolanost-8-en-26-oic acid, 7,12,23-trihydroxy-3,11,15-trioxo-, γ-lactone, (7β,12β,16α,23β,25R)-;

标识符

InChIKey:
BINIQAMAYCKIRZ-UHFFFAOYSA-N
Inchi:
1S/C30H40O7/c1-13-11-30(12-14(2)25(36)37-30)21-18(13)28(6)24(35)22(33)20-19(29(28,7)23(21)34)15(31)10-16-26(3,4)17(32)8-9-27(16,20)5/h13-16,18,21,24,31,35H,8-12H2,1-7H3
SMILES:
O=C1C2(C3C(CC4C(C(=O)CCC4(C)C=3C(=O)C(O)C2(C)C2C(C)CC3(OC(=O)C(C)C3)C12)(C)C)O)C

赤芝孢子内酯A(138008-04-5)物化性质

实验特性

  • PSA : 138.2
  • 沸点 : 712.4±60.0 °C(Predicted)
  • 酸度系数(pKa) : 12.11±0.70(Predicted)
  • 密度 : 1.30±0.1 g/cm3(Predicted)

计算特性

  • 精确分子量 : 528.2724