Details
Stereochemistry | ABSOLUTE |
Molecular Formula | C32H31O14.Na |
Molecular Weight | 662.5699 |
Optical Activity | UNSPECIFIED |
Defined Stereocenters | 10 / 10 |
E/Z Centers | 0 |
Charge | 0 |
SHOW SMILES / InChI
SMILES
[Na+].[H][C@]7(O[C@@H]1[C@@H](O)[C@@H](O)[C@@H](C)O[C@H]1OC2=CC=CC3=C([O-])C4=C5C(OC(=O)C6=C(C)C=CC(OC4=O)=C56)=C23)O[C@H](C)[C@H](O)[C@H](OC)[C@H]7O
InChI
InChIKey=VAQXDDCZGDHANK-VUEGQKLDSA-M
InChI=1S/C32H32O14.Na/c1-10-8-9-15-18-16(10)29(38)45-26-17-13(23(35)20(19(18)26)30(39)43-15)6-5-7-14(17)44-32-28(24(36)21(33)11(2)42-32)46-31-25(37)27(40-4)22(34)12(3)41-31;/h5-9,11-12,21-22,24-25,27-28,31-37H,1-4H3;/q;+1/p-1/t11-,12-,21+,22+,24+,25-,27+,28-,31-,32+;/m1./s1
Molecular Formula | C32H31O14 |
Molecular Weight | 639.5801 |
Charge | -1 |
Count |
|
Stereochemistry | ABSOLUTE |
Additional Stereochemistry | No |
Defined Stereocenters | 10 / 10 |
E/Z Centers | 0 |
Optical Activity | UNSPECIFIED |
Molecular Formula | Na |
Molecular Weight | 22.9898 |
Charge | 1 |
Count |
|
Stereochemistry | ACHIRAL |
Additional Stereochemistry | No |
Defined Stereocenters | 0 / 0 |
E/Z Centers | 0 |
Optical Activity | NONE |
Approval Year
Substance Class |
Chemical
Created
by
admin
on
Edited
Sat Dec 16 10:04:42 GMT 2023
by
admin
on
Sat Dec 16 10:04:42 GMT 2023
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Record UNII |
5CX1UZ8Q17
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Record Status |
Validated (UNII)
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Record Version |
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-
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90478402
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1393-72-2
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5CX1UZ8Q17
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DTXSID20161001
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m3314
Created by
admin on Sat Dec 16 10:04:42 GMT 2023 , Edited by admin on Sat Dec 16 10:04:42 GMT 2023
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PRIMARY | Merck Index |
Related Record | Type | Details | ||
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ACTIVE MOIETY |