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Glucuronosyletoposide
Properties
Image
Occurences in reactions
MNX_ID
MNXM731910
#reac
in my sandbox
0
in MNXref (generic)
1
in models (compartimentalized)
0
formula
C
35
H
39
O
19
charge
-1
mass
763.2091
reference
sabiorkM:13318
InChIKey
URCVASXWNJQAEH-KAYSAPKKSA-M
InChI
InChI=1S/C35H40O19/c1-11-46-9-20-30(50-11)25(38)27(40)34(51-20)52-28-14-7-17-16(48-10-49-17)6-13(14)21(22-15(28)8-47-33(22)43)12-4-18(44-2)29(19(5-12)45-3)53-35-26(39)23(36)24(37)31(54-35)32(41)42/h4-7,11,15,20-28,30-31,34-40H,8-10H2,1-3H3,(H,41,42)/p-1/t11?,15-,20?,21+,22-,23-,24-,25?,26+,27?,28+,30?,31-,34?,35+/m0/s1
SMILES
COc1cc([C@@H]2c3cc4c(cc3[C@@H](OC3OC5COC(C)OC5C(O)C3O)[C@H]3COC(=O)[C@H]23)OCO4)cc(OC)c1O[C@@H]1O[C@H](C(=O)[O-])[C@@H](O)[C@H](O)[C@H]1O
Parent-child relations graph
Deprecated MNXref IDs graph
Similar chemical compounds in external resources
Identifier
Description
sabiork.compound:13318
sabiorkM:13318
Glucuronosyletoposide
Etoposide glucuronide