28'-amino-1,7,8',13',22'-pentahydroxy-4',8'-dimethyl-8-(8-methyl-4-methylidenenona-2,7-dien-1-ylidene)-3,3a,4,5,6,7,8,8a-octahydro-1H-24',27'-diazaspiro[azulene-2,9'-pentacyclo[23.7.1.1¹⁵,¹⁹.0⁵,¹⁰.0²⁹
AlkaPlorer ID: AK584565
Synonym: None
IUPAC Name: 28'-amino-1,7,8',13',22'-pentahydroxy-4',8'-dimethyl-8-(8-methyl-4-methylidenenona-2,7-dienylidene)spiro[1,3,3a,4,5,6,7,8a-octahydroazulene-2,9'-24,27-diazapentacyclo[23.7.1.115,19.05,10.029,33]tetratriaconta-1(33),4,15,17,19(34),29,31-heptaene]-3',26'-dione
Structure
SMILES: C=C(C=CC=C1C(O)CCCC2CC3(C4CCC(O)CC5=CC=CC(=C5)CCC(O)CNC5C(=O)NC(N)C6=CC=CC(=C65)CC(=O)C(C)=C4CCC3(C)O)C(O)C12)CCC=C(C)C
InChI: InChI=1S/C54H73N3O7/c1-32(2)11-6-12-33(3)13-7-18-42-45(60)20-10-17-38-30-54(50(62)48(38)42)44-24-23-39(58)28-36-15-8-14-35(27-36)21-22-40(59)31-56-49-47-37(16-9-19-43(47)51(55)57-52(49)63)29-46(61)34(4)41(44)25-26-53(54,5)64/h7-9,11,13-16,18-19,27,38-40,44-45,48-51,56,58-60,62,64H,3,6,10,12,17,20-26,28-31,55H2,1-2,4-5H3,(H,57,63)
InChIKey: YRIGRKOCTAWUQQ-UHFFFAOYSA-N
Source
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Properties Information
Molecule Weight: 876.1919999999996
TPSA？: 185.37
MolLogP？: 6.997800000000008
Number of H-Donors: 8
Number of H-Acceptors: 9
RingCount: 7
Activities Information
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