Chemistry:Elsamitrucin

Elsamitrucin
Clinical data
ATC code	none;
Identifiers
	IUPAC name 10-[3-(3-Amino-5-hydroxy-4-methoxy-6-methyl-tetrahydro-pyran-2-yloxy)-4,5-dihydroxy-4,6-dimethyl-tetrahydro-pyran-2-yloxy]-6-hydroxy-1-methyl-benzo[h]chromeno[5,4,3-cde]chromene-5,12-dione;
CAS Number	97068-30-9 ;
PubChem CID	5362259;
ChemSpider	4514988;
UNII	ZTV0FOB6NU;
Chemical and physical data
Formula	C33H35NO13
Molar mass	653.637 g·mol−1
3D model (JSmol)	Interactive image;
	SMILES Cc1ccc2c3c1c(=O)oc4c3c(c(c5c4c(ccc5)O[C@H]6[C@@H]([C@@]([C@H]([C@H](O6)C)O)(C)O)O[C@@H]7[C@@H]([C@H]([C@H]([C@H](O7)C)O)OC)N)O)c(=O)o2;
	InChI InChI=1S/C33H35NO13/c1-11-9-10-16-19-17(11)29(38)46-25-18-14(24(36)21(20(19)25)30(39)44-16)7-6-8-15(18)45-32-28(33(4,40)27(37)13(3)43-32)47-31-22(34)26(41-5)23(35)12(2)42-31/h6-10,12-13,22-23,26-28,31-32,35-37,40H,34H2,1-5H3/t12-,13-,22-,23+,26-,27+,28+,31-,32+,33+/m1/s1; Key:MGQRRMONVLMKJL-KWJIQSIXSA-N;
	(verify)

Short description: Chemical compound

Elsamitrucin (elsamicin A) is a drug used in chemotherapy.^[1] Elsamitrucin is chemically related to chartreusin.^{[citation needed]}

References

↑ "Elsamicin A binding to DNA. A comparative thermodynamic characterization". FEBS Letters 576 (1–2): 68–72. October 2004. doi:10.1016/j.febslet.2004.08.063. PMID 15474012.

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Clinical data

ATC code	none
Identifiers
IUPAC name 10-[3-(3-Amino-5-hydroxy-4-methoxy-6-methyl-tetrahydro-pyran-2-yloxy)-4,5-dihydroxy-4,6-dimethyl-tetrahydro-pyran-2-yloxy]-6-hydroxy-1-methyl-benzo[h]chromeno[5,4,3-cde]chromene-5,12-dione
CAS Number	97068-30-9^Y
PubChem CID	5362259
ChemSpider	4514988
UNII	ZTV0FOB6NU
Chemical and physical data
Formula	C₃₃H₃₅NO₁₃
Molar mass	653.637 g·mol⁻¹
3D model (JSmol)	Interactive image
SMILES Cc1ccc2c3c1c(=O)oc4c3c(c(c5c4c(ccc5)O[C@H]6[C@@H]([C@@]([C@H]([C@H](O6)C)O)(C)O)O[C@@H]7[C@@H]([C@H]([C@H]([C@H](O7)C)O)OC)N)O)c(=O)o2
InChI InChI=1S/C33H35NO13/c1-11-9-10-16-19-17(11)29(38)46-25-18-14(24(36)21(20(19)25)30(39)44-16)7-6-8-15(18)45-32-28(33(4,40)27(37)13(3)43-32)47-31-22(34)26(41-5)23(35)12(2)42-31/h6-10,12-13,22-23,26-28,31-32,35-37,40H,34H2,1-5H3/t12-,13-,22-,23+,26-,27+,28+,31-,32+,33+/m1/s1 Key:MGQRRMONVLMKJL-KWJIQSIXSA-N
(verify)