Nazwa analitu

4'-(O-Podophyllotoxin-9-oxy) Etoposide

Wzór cząsteczkowy

C50H50O20

Masa cząsteczkowa

970.92

Dokładna masa

970.29

SMILES

O=C1OC[C@@]([C@H](O[C@H]2[C@H](O)[C@@H](O)[C@H]3[C@@H](CO[C@@]([H])(C)O3)O2)C4=C5C=C6C(OCO6)=C4)([H])[C@H]1[C@@H]5C7=CC(OC)=C(O[C@H](C8=C9C=C%10C(OCO%10)=C8)[C@]%11([H])[C@H](C(OC%11)=O)[C@@H]9C%12=CC(OC)=C(O)C(OC)=C%12)C(OC)=C7

InChI

InChI=1S/C50H50O20/c1-19-60-16-36-47(67-19)42(52)43(53)50(68-36)70-45-25-13-31-29(64-18-66-31)11-23(25)38(40-27(45)15-62-49(40)55)21-8-34(58-4)46(35(9-21)59-5)69-44-24-12-30-28(63-17-65-30)10-22(24)37(39-26(44)14-61-48(39)54)20-6-32(56-2)41(51)33(7-20)57-3/h6-13,19,26-27,36-40,42-45,47,50-53H,14-18H2,1-5H3/t19-,26+,27+,36-,37-,38-,39+,40+,42-,43-,44+,45-,47-,50+/m1/s1

IUPAC

(5R,5aR,8aR,9S)-9-(((2R,4aR,6R,7R,8R,8aS)-7,8-dihydroxy-2-methylhexahydropyrano[3,2-d][1,3]dioxin-6-yl)oxy)-5-(4-(((5S,5aR,8aR,9R)-9-(4-hydroxy-3,5-dimethoxyphenyl)-8-oxo-5,5a,6,8,8a,9-hexahydrofuro[3',4':6,7]naphtho[2,3-d][1,3]dioxol-5-yl)oxy)-3,5-dimethoxyphenyl)-5,8,8a,9-tetrahydrofuro[3',4':6,7]naphtho[2,3-d][1,3]dioxol-6(5aH)-one

Zastępczy numer CAS

149839-65-6

Temperatura podczas transportu

Room Temperature

Kraj pochodzenia

CANADA

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