CAV protocol

Structure Molecule image
Relationships Total Number of functionally related protein(s) : 721
Total Number of Articles : 887
PubChem 56841665
Molecular Formula

C80H100Cl2N7O23P

SMILES

CC[C@@]1(C[C@H]2C[C@@](C3=C(CCN(C2)C1)C4=CC=CC=C4N3)(C5=C(C6=C(C=C5)[C@]78CCN9[C@H]7[C@@](C=CC9)([C@H]([C@@]([C@@H]8N6C=O)(C(=O)OC)O)OC(=O)C)CC)OC)C(=O)OC)O.C[C@H]1[C@H]([C@H](C[C@@H](O1)O[C@H]2C[C@@](CC3=C2C(=C4C(=C3O)C(=O)C5=C(C4=O)C(=CC=C5)OC)O)(C(=O)CO)O)N)O.C1CNP(=O)(OC1)N(CCCl)CCCl

InChI

InChI=1S/C46H56N4O10.C27H29NO11.C7H15Cl2N2O2P/c1-7-42(55)22-28-23-45(40(53)58-5,36-30(16-20-48(24-28)25-42)29-12-9-10-13-33(29)47-36)32-15-14-31-34(35(32)57-4)50(26-51)38-44(31)18-21-49-19-11-17-43(8-2,37(44)49)39(60-27(3)52)46(38,56)41(54)59-6;1-10-22(31)13(28)6-17(38-10)39-15-8-27(36,16(30)9-29)7-12-19(15)26(35)21-20(24(12)33)23(32)11-4-3-5-14(37-2)18(11)25(21)34;8-2-5-11(6-3-9)14(12)10-4-1-7-13-14/h9-15,17,26,28,37-39,47,55-56H,7-8,16,18-25H2,1-6H3;3-5,10,13,15,17,22,29,31,33,35-36H,6-9,28H2,1-2H3;1-7H2,(H,10,12)/t28-,37-,38+,39+,42-,43+,44+,45-,46-;10-,13-,15-,17-,22+,27-;/m00./s1

synonyms
  • CAV protocol
  • CAV regimen
  • Cyclophosphamide / Doxorubicin / Vincristine regimen
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Properties
Property Value
MW 1629.6 g/mol
HBD 10
HBA 28
Rotatable Bond Count 20
Exact Mass 1627.5985248 g/mol
Monoisotopic Mass 1627.5985248 g/mol
Heavy Atom Count 113
Isotope Atom Count 0
Atom Stereo Count 16
Covalent Unit Count 3
Complexity 2940
xlogp None
Topological Polar Surface Area 419